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CHEMISTRY

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Chemistry

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Also known as: 146270-01-1, Pyridine, 2-chloro-4-(1-piperidinylmethyl)-, 2-chloro-4-(1-piperidinomethyl)pyridine, 2-chloro-4-((piperidin-1-yl)methyl)pyridine, 2-chloro-4-(1-piperidylmethyl)pyridine, 2-chloro-4-[(piperidin-1-yl)methyl]pyridine

Molecular Formula

C₁₁H₁₅ClN₂

Molecular Weight

210.70 g/mol

InChI Key

FCGXHPOYGAGSIQ-UHFFFAOYSA-N

CAS 146270-01-1

1 2D Structure

CAS 146270-01-1

2 Identification

2.1 Computed Descriptors

2.1.1 IUPAC Name

2-chloro-4-(piperidin-1-ylmethyl)pyridine

2.1.2 InChI

InChI=1S/C11H15ClN2/c12-11-8-10(4-5-13-11)9-14-6-2-1-3-7-14/h4-5,8H,1-3,6-7,9H2

2.1.3 InChI Key

FCGXHPOYGAGSIQ-UHFFFAOYSA-N

2.1.4 Canonical SMILES

C1CCN(CC1)CC2=CC(=NC=C2)Cl

2.2 Synonyms

2.2.1 Depositor-Supplied Synonyms

1. 146270-01-1

2. Pyridine, 2-chloro-4-(1-piperidinylmethyl)-

3. 2-chloro-4-(1-piperidinomethyl)pyridine

4. 2-chloro-4-((piperidin-1-yl)methyl)pyridine

5. 2-chloro-4-(1-piperidylmethyl)pyridine

6. 2-chloro-4-[(piperidin-1-yl)methyl]pyridine

7. 2-chloro-4-(1-piperidinylmethyl)pyridine

8. 2-chloro-4-(1-piperidinylmethyl) Pyridine

9. Schembl7606866

10. Dtxsid30431843

11. Wfa27001

12. Mfcd02684341

13. Phenylamino-aceticacidhydrazide

14. Akos011323907

15. As-19703

16. Db-024381

17. A3188

18. Cs-0158827

19. D86945

20. A1-20556

21. 2-chloro-4-piperidin-1-ylmethyl-pyridine;2-chloro-4-(1-piperidinomethyl)pyridine

2.3 Create Date

2006-10-25

3 Chemical and Physical Properties

Molecular Formula	C₁₁H₁₅ClN₂
Molecular Weight	210.70 g/mol
XLogP3	2.5
Hydrogen Bond Donor Count	0
Hydrogen Bond Acceptor Count	2
Rotatable Bond Count	2
Exact Mass	g/mol
Monoisotopic Mass	g/mol
Topological Polar Surface Area	16.1
Heavy Atom Count	14
Formal Charge	0
Complexity	169
Isotope Atom Count	0
Defined Atom Stereocenter Count	0
Undefined Atom Stereocenter Count	0
Defined Bond Stereocenter Count	0
Undefined Bond Stereocenter Count	0
Covalently Bonded Unit Count	1

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