2-cyclopentyl-2-hydroxy-2-phenyl-N-[1-(pyridin-2-ylmethyl)piperidin-4-yl]acetamide

C24H31N3O2 — CID 11794901

IUPAC2-cyclopentyl-2-hydroxy-2-phenyl-N-[1-(pyridin-2-ylmethyl)piperidin-4-yl]acetamide
SMILESO=C(NC1CCN(Cc2ccccn2)CC1)C(O)(c1ccccc1)C1CCCC1
InChIInChI=1S/C24H31N3O2/c28-23(24(29,20-10-4-5-11-20)19-8-2-1-3-9-19)26-21-13-16-27(17-14-21)18-22-12-6-7-15-25-22/h1-3,6-9,12,15,20-21,29H,4-5,10-11,13-14,16-18H2,(H,26,28)
InChIKeyIASYIMACMPYPDM-UHFFFAOYSA-N
MW393.53 g/mol
LogP3.24
Rot. Bonds6

About 2-cyclopentyl-2-hydroxy-2-phenyl-N-[1-(pyridin-2-ylmethyl)piperidin-4-yl]acetamide

2-cyclopentyl-2-hydroxy-2-phenyl-N-[1-(pyridin-2-ylmethyl)piperidin-4-yl]acetamide (PubChem CID 11794901) has the molecular formula C24H31N3O2 and a molecular weight of 393.53 g/mol. Its IUPAC name is 2-cyclopentyl-2-hydroxy-2-phenyl-N-[1-(pyridin-2-ylmethyl)piperidin-4-yl]acetamide.

Molecular Properties

Compound Name2-cyclopentyl-2-hydroxy-2-phenyl-N-[1-(pyridin-2-ylmethyl)piperidin-4-yl]acetamide
PubChem CID11794901
Molecular FormulaC24H31N3O2
Molecular Weight393.53 g/mol
Exact Mass393.24
IUPAC Name2-cyclopentyl-2-hydroxy-2-phenyl-N-[1-(pyridin-2-ylmethyl)piperidin-4-yl]acetamide
SMILESO=C(NC1CCN(Cc2ccccn2)CC1)C(O)(c1ccccc1)C1CCCC1
InChIInChI=1S/C24H31N3O2/c28-23(24(29,20-10-4-5-11-20)19-8-2-1-3-9-19)26-21-13-16-27(17-14-21)18-22-12-6-7-15-25-22/h1-3,6-9,12,15,20-21,29H,4-5,10-11,13-14,16-18H2,(H,26,28)
InChIKeyIASYIMACMPYPDM-UHFFFAOYSA-N
XLogP3.24
TPSA65.46 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds6
Heavy Atoms29
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500393.53
LogP ≤ 53.24
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Related Compounds

Alpha-(3-hydroxy-2-oxo-3-indolinyl)-2-methylpyridine
CID 22733
(2R)-N-(1-(6-aminopyridin-2-ylmethyl)piperidin-4-yl)-2-((1R)-3,3-difluorocyclopentyl)-2-hydroxy-2-phenylacetamide
CID 9846311
[4-(3-Hydroxy-3,3-diphenyl-propionyl)-piperazin-1-yl]-(2-methyl-pyridin-3-yl)-acetonitrile
CID 9889462
(2-Methyl-pyridin-3-yl)-[4-(4,4,4-trifluoro-3-hydroxy-3-phenyl-butyryl)-piperazin-1-yl]-acetonitrile
CID 10002913
[4-(3-Hydroxy-3,3-diphenyl-propionyl)-piperazin-1-yl]-pyridin-3-yl-acetonitrile
CID 10410208
[4-(3-Hydroxy-3-phenyl-butyryl)-piperazin-1-yl]-(2-methyl-pyridin-3-yl)-acetonitrile
CID 10474804
2-(3,3-Difluoro-cyclopentyl)-2-hydroxy-N-[1-(6-methyl-pyridin-2-ylmethyl)-piperidin-4-yl]-2-phenyl-acetamide
CID 10718110
2-(3,3-Difluoro-cyclopentyl)-2-hydroxy-2-phenyl-N-(1-pyridin-2-ylmethyl-piperidin-4-yl)-acetamide
CID 10836338
((3S,4R)-1-tert-butyl-4-(2,4-difluorophenyl)pyrrolidin-3-yl)((3S,4R,5R)-4-hydroxy-3,5-dimethyl-4-(pyridin-2-yl)piperidin-1-yl)methanone
CID 46885815
(R)-Phenyl[(2R,5S)-5-(4-{[4-(pyridin-2-ylmethyl)piperazin-1-yl]carbonyl}benzyl)pyrrolidin-2-yl]methanol
CID 67972431
Benzilamide, N-allyl-N-(4-pyridylmethyl)-
CID 380040
Smy-540
CID 86288969

Frequently Asked Questions

What is the IUPAC name of 2-cyclopentyl-2-hydroxy-2-phenyl-N-[1-(pyridin-2-ylmethyl)piperidin-4-yl]acetamide?
The IUPAC name of 2-cyclopentyl-2-hydroxy-2-phenyl-N-[1-(pyridin-2-ylmethyl)piperidin-4-yl]acetamide (CID 11794901) is 2-cyclopentyl-2-hydroxy-2-phenyl-N-[1-(pyridin-2-ylmethyl)piperidin-4-yl]acetamide.
What is the SMILES notation for 2-cyclopentyl-2-hydroxy-2-phenyl-N-[1-(pyridin-2-ylmethyl)piperidin-4-yl]acetamide?
The canonical SMILES for 2-cyclopentyl-2-hydroxy-2-phenyl-N-[1-(pyridin-2-ylmethyl)piperidin-4-yl]acetamide is O=C(NC1CCN(Cc2ccccn2)CC1)C(O)(c1ccccc1)C1CCCC1.
What is the InChIKey of 2-cyclopentyl-2-hydroxy-2-phenyl-N-[1-(pyridin-2-ylmethyl)piperidin-4-yl]acetamide?
The InChIKey is IASYIMACMPYPDM-UHFFFAOYSA-N. The full InChI is InChI=1S/C24H31N3O2/c28-23(24(29,20-10-4-5-11-20)19-8-2-1-3-9-19)26-21-13-16-27(17-14-21)18-22-12-6-7-15-25-22/h1-3,6-9,12,15,20-21,29H,4-5,10-11,13-14,16-18H2,(H,26,28).
What are the key properties of 2-cyclopentyl-2-hydroxy-2-phenyl-N-[1-(pyridin-2-ylmethyl)piperidin-4-yl]acetamide?
2-cyclopentyl-2-hydroxy-2-phenyl-N-[1-(pyridin-2-ylmethyl)piperidin-4-yl]acetamide has a molecular weight of 393.53 g/mol, XLogP of 3.24, 6 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-cyclopentyl-2-hydroxy-2-phenyl-N-[1-(pyridin-2-ylmethyl)piperidin-4-yl]acetamide is sourced from PubChem (CID 11794901), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).