3-chloro-5-phenyl-2-piperidin-1-ylpyridine

C16H17ClN2 — CID 156810422

IUPAC3-chloro-5-phenyl-2-piperidin-1-ylpyridine
SMILESClc1cc(-c2ccccc2)cnc1N1CCCCC1
InChIInChI=1S/C16H17ClN2/c17-15-11-14(13-7-3-1-4-8-13)12-18-16(15)19-9-5-2-6-10-19/h1,3-4,7-8,11-12H,2,5-6,9-10H2
InChIKeyRWTFRTZJJIPUJY-UHFFFAOYSA-N
MW272.78 g/mol
LogP4.39
Rot. Bonds2

About 3-chloro-5-phenyl-2-piperidin-1-ylpyridine

3-chloro-5-phenyl-2-piperidin-1-ylpyridine (PubChem CID 156810422) has the molecular formula C16H17ClN2 and a molecular weight of 272.78 g/mol. Its IUPAC name is 3-chloro-5-phenyl-2-piperidin-1-ylpyridine.

Molecular Properties

Compound Name3-chloro-5-phenyl-2-piperidin-1-ylpyridine
PubChem CID156810422
Molecular FormulaC16H17ClN2
Molecular Weight272.78 g/mol
Exact Mass272.11
IUPAC Name3-chloro-5-phenyl-2-piperidin-1-ylpyridine
SMILESClc1cc(-c2ccccc2)cnc1N1CCCCC1
InChIInChI=1S/C16H17ClN2/c17-15-11-14(13-7-3-1-4-8-13)12-18-16(15)19-9-5-2-6-10-19/h1,3-4,7-8,11-12H,2,5-6,9-10H2
InChIKeyRWTFRTZJJIPUJY-UHFFFAOYSA-N
XLogP4.39
TPSA16.13 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500272.78
LogP ≤ 54.39
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Related Compounds

5-chloro-2-phenyl-4-piperidin-1-ylpyrimidine
CID 59517761
[4-[3-chloro-5-(piperidine-1-carbonyl)-2-pyridinyl]-1,4-diazepan-1-yl]-phenylmethanone
CID 133270887
3-chloro-2-piperidin-1-yl-5-propan-2-ylpyridine
CID 59019495
4-[4-(3,5-dichloro-2-pyridinyl)piperazin-1-yl]-6-piperidin-1-ylpyrimidine
CID 133297534
[4-(3,5-dichloro-2-pyridinyl)piperazin-1-yl]-(3-phenyl-6,7,8,9-tetrahydro-5H-imidazo[1,5-a]azepin-1-yl)methanone
CID 55807787
N-[(5-chloro-6-piperidin-1-yl-3-pyridinyl)methyl]-2-methylpropan-2-amine
CID 62281197
6-phenyl-2-pyrrolidin-1-ylfuro[3,2-b]pyridine;dihydrochloride
CID 19597556
1-(5-chloropyrimidin-4-yl)azepane;hydrochloride
CID 172880685
[4-[3-chloro-5-(piperidine-1-carbonyl)-2-pyridinyl]piperazin-1-yl]-(2-hydroxyphenyl)methanone
CID 56584912
6-phenyl-5-piperidin-1-yl-1,2,4-triazine
CID 6401390
sodium;4-(3,5-dichloro-2-pyridinyl)morpholine;phenoxide
CID 157429238
2-phenyl-4-piperidin-1-ylpyrimidine-5-carboxylic acid
CID 42669942

Frequently Asked Questions

What is the IUPAC name of 3-chloro-5-phenyl-2-piperidin-1-ylpyridine?
The IUPAC name of 3-chloro-5-phenyl-2-piperidin-1-ylpyridine (CID 156810422) is 3-chloro-5-phenyl-2-piperidin-1-ylpyridine.
What is the SMILES notation for 3-chloro-5-phenyl-2-piperidin-1-ylpyridine?
The canonical SMILES for 3-chloro-5-phenyl-2-piperidin-1-ylpyridine is Clc1cc(-c2ccccc2)cnc1N1CCCCC1.
What is the InChIKey of 3-chloro-5-phenyl-2-piperidin-1-ylpyridine?
The InChIKey is RWTFRTZJJIPUJY-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H17ClN2/c17-15-11-14(13-7-3-1-4-8-13)12-18-16(15)19-9-5-2-6-10-19/h1,3-4,7-8,11-12H,2,5-6,9-10H2.
What are the key properties of 3-chloro-5-phenyl-2-piperidin-1-ylpyridine?
3-chloro-5-phenyl-2-piperidin-1-ylpyridine has a molecular weight of 272.78 g/mol, XLogP of 4.39, 2 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 3-chloro-5-phenyl-2-piperidin-1-ylpyridine is sourced from PubChem (CID 156810422), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).