2-chloro-6-(piperidin-1-ylmethyl)pyridine

C11H15ClN2 — CID 13388686

IUPAC2-chloro-6-(piperidin-1-ylmethyl)pyridine
SMILESClc1cccc(CN2CCCCC2)n1
InChIInChI=1S/C11H15ClN2/c12-11-6-4-5-10(13-11)9-14-7-2-1-3-8-14/h4-6H,1-3,7-9H2
InChIKeyDYOQBLRQWTZYLB-UHFFFAOYSA-N
MW210.71 g/mol
LogP2.72
Rot. Bonds2

About 2-chloro-6-(piperidin-1-ylmethyl)pyridine

2-chloro-6-(piperidin-1-ylmethyl)pyridine (PubChem CID 13388686) has the molecular formula C11H15ClN2 and a molecular weight of 210.71 g/mol. Its IUPAC name is 2-chloro-6-(piperidin-1-ylmethyl)pyridine.

Molecular Properties

Compound Name2-chloro-6-(piperidin-1-ylmethyl)pyridine
PubChem CID13388686
Molecular FormulaC11H15ClN2
Molecular Weight210.71 g/mol
Exact Mass210.09
IUPAC Name2-chloro-6-(piperidin-1-ylmethyl)pyridine
SMILESClc1cccc(CN2CCCCC2)n1
InChIInChI=1S/C11H15ClN2/c12-11-6-4-5-10(13-11)9-14-7-2-1-3-8-14/h4-6H,1-3,7-9H2
InChIKeyDYOQBLRQWTZYLB-UHFFFAOYSA-N
XLogP2.72
TPSA16.13 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500210.71
LogP ≤ 52.72
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

Structural Alerts{'alert_name': '2-halo_pyridine', 'substructure': 'N/A'}

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Related Compounds

1-[(6-chloro-2-pyridinyl)methyl]-4-ethylazepane
CID 79038526
1-[(6-chloro-2-pyridinyl)methyl]-4-cyclopropylpiperazine
CID 79038510
2-chloro-6-[(4,4-diethylpiperidin-1-yl)methyl]pyridine
CID 79240655
2-chloro-6-[(3-pyrrolidin-1-ylpyrrolidin-1-yl)methyl]pyridine
CID 79037923
6-(piperidin-1-ylmethyl)pyridine-2-carboxamide
CID 66911251
1-[4-[(6-chloro-2-pyridinyl)methyl]piperazin-1-yl]-2-methylpropan-2-ol
CID 79038456
1-[(6-chloro-2-pyridinyl)methyl]-N-methylpiperidine-4-carboxamide
CID 79039473
1-[6-(azocan-1-ylmethyl)-2-pyridinyl]-N-methylmethanamine
CID 106905663
2-methoxy-6-(piperidin-1-ylmethyl)pyridine
CID 70652671
6-(azepan-1-ylmethyl)pyridine-2-carboxylic acid
CID 106903922
[6-(azetidin-1-ylmethyl)-2-pyridinyl]methanamine
CID 105437203
1-[(6-chloro-2-pyridinyl)methyl]-3-methylpyrrolidin-3-ol
CID 103728462

Frequently Asked Questions

What is the IUPAC name of 2-chloro-6-(piperidin-1-ylmethyl)pyridine?
The IUPAC name of 2-chloro-6-(piperidin-1-ylmethyl)pyridine (CID 13388686) is 2-chloro-6-(piperidin-1-ylmethyl)pyridine.
What is the SMILES notation for 2-chloro-6-(piperidin-1-ylmethyl)pyridine?
The canonical SMILES for 2-chloro-6-(piperidin-1-ylmethyl)pyridine is Clc1cccc(CN2CCCCC2)n1.
What is the InChIKey of 2-chloro-6-(piperidin-1-ylmethyl)pyridine?
The InChIKey is DYOQBLRQWTZYLB-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H15ClN2/c12-11-6-4-5-10(13-11)9-14-7-2-1-3-8-14/h4-6H,1-3,7-9H2.
What are the key properties of 2-chloro-6-(piperidin-1-ylmethyl)pyridine?
2-chloro-6-(piperidin-1-ylmethyl)pyridine has a molecular weight of 210.71 g/mol, XLogP of 2.72, 2 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-chloro-6-(piperidin-1-ylmethyl)pyridine is sourced from PubChem (CID 13388686), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).