3-chloro-4-piperidin-3-ylpyridine

C10H13ClN2 — CID 82399188

IUPAC3-chloro-4-piperidin-3-ylpyridine
SMILESClc1cnccc1C1CCCNC1
InChIInChI=1S/C10H13ClN2/c11-10-7-13-5-3-9(10)8-2-1-4-12-6-8/h3,5,7-8,12H,1-2,4,6H2
InChIKeyHNKYNXSDIFJVLL-UHFFFAOYSA-N
MW196.68 g/mol
LogP2.20
Rot. Bonds1

About 3-chloro-4-piperidin-3-ylpyridine

3-chloro-4-piperidin-3-ylpyridine (PubChem CID 82399188) has the molecular formula C10H13ClN2 and a molecular weight of 196.68 g/mol. Its IUPAC name is 3-chloro-4-piperidin-3-ylpyridine.

Molecular Properties

Compound Name3-chloro-4-piperidin-3-ylpyridine
PubChem CID82399188
Molecular FormulaC10H13ClN2
Molecular Weight196.68 g/mol
Exact Mass196.08
IUPAC Name3-chloro-4-piperidin-3-ylpyridine
SMILESClc1cnccc1C1CCCNC1
InChIInChI=1S/C10H13ClN2/c11-10-7-13-5-3-9(10)8-2-1-4-12-6-8/h3,5,7-8,12H,1-2,4,6H2
InChIKeyHNKYNXSDIFJVLL-UHFFFAOYSA-N
XLogP2.20
TPSA24.92 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds1
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500196.68
LogP ≤ 52.20
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

2,5-dichloro-4-piperidin-3-ylpyridine
CID 84694263
4-piperidin-3-ylpyridine;dihydrochloride
CID 91809614
(3R)-3-(4-bromo-2-chlorophenyl)piperidine
CID 130852856
3-chloro-4-piperidin-3-ylphenol
CID 82612870
3-bromo-4-[(3S)-pyrrolidin-3-yl]pyridine
CID 99905887
(3S)-3-(2,5-dichlorophenyl)piperidine
CID 93478490
3-(2,3-dichlorophenyl)piperidine
CID 24904244
4-[(2S)-azetidin-2-yl]-3-chloropyridine;hydrochloride
CID 171196638
3-chloro-6-piperidin-3-ylbenzene-1,2-diol
CID 117327832
3-chloro-N-methyl-N-piperidin-3-ylpyridin-4-amine
CID 79841702
4-chloro-3-piperidin-3-ylphenol
CID 84678781
2,3-dimethyl-4-piperidin-3-ylpyridine
CID 84662825

Frequently Asked Questions

What is the IUPAC name of 3-chloro-4-piperidin-3-ylpyridine?
The IUPAC name of 3-chloro-4-piperidin-3-ylpyridine (CID 82399188) is 3-chloro-4-piperidin-3-ylpyridine.
What is the SMILES notation for 3-chloro-4-piperidin-3-ylpyridine?
The canonical SMILES for 3-chloro-4-piperidin-3-ylpyridine is Clc1cnccc1C1CCCNC1.
What is the InChIKey of 3-chloro-4-piperidin-3-ylpyridine?
The InChIKey is HNKYNXSDIFJVLL-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H13ClN2/c11-10-7-13-5-3-9(10)8-2-1-4-12-6-8/h3,5,7-8,12H,1-2,4,6H2.
What are the key properties of 3-chloro-4-piperidin-3-ylpyridine?
3-chloro-4-piperidin-3-ylpyridine has a molecular weight of 196.68 g/mol, XLogP of 2.20, 1 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 3-chloro-4-piperidin-3-ylpyridine is sourced from PubChem (CID 82399188), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).