N-(1-benzylpiperidin-2-yl)-4-hydroxybenzamide

C19H22N2O2 — CID 141121427

IUPACN-(1-benzylpiperidin-2-yl)-4-hydroxybenzamide
SMILESO=C(NC1CCCCN1Cc1ccccc1)c1ccc(O)cc1
InChIInChI=1S/C19H22N2O2/c22-17-11-9-16(10-12-17)19(23)20-18-8-4-5-13-21(18)14-15-6-2-1-3-7-15/h1-3,6-7,9-12,18,22H,4-5,8,13-14H2,(H,20,23)
InChIKeyPUPUCYICJULHCZ-UHFFFAOYSA-N
MW310.40 g/mol
LogP3.13
Rot. Bonds4

About N-(1-benzylpiperidin-2-yl)-4-hydroxybenzamide

N-(1-benzylpiperidin-2-yl)-4-hydroxybenzamide (PubChem CID 141121427) has the molecular formula C19H22N2O2 and a molecular weight of 310.40 g/mol. Its IUPAC name is N-(1-benzylpiperidin-2-yl)-4-hydroxybenzamide.

Molecular Properties

Compound NameN-(1-benzylpiperidin-2-yl)-4-hydroxybenzamide
PubChem CID141121427
Molecular FormulaC19H22N2O2
Molecular Weight310.40 g/mol
Exact Mass310.17
IUPAC NameN-(1-benzylpiperidin-2-yl)-4-hydroxybenzamide
SMILESO=C(NC1CCCCN1Cc1ccccc1)c1ccc(O)cc1
InChIInChI=1S/C19H22N2O2/c22-17-11-9-16(10-12-17)19(23)20-18-8-4-5-13-21(18)14-15-6-2-1-3-7-15/h1-3,6-7,9-12,18,22H,4-5,8,13-14H2,(H,20,23)
InChIKeyPUPUCYICJULHCZ-UHFFFAOYSA-N
XLogP3.13
TPSA52.57 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500310.40
LogP ≤ 53.13
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

tert-butyl N-[(2S)-1-benzylpyrrolidin-2-yl]carbamate
CID 10754954
2-benzamidopiperidine-1-carboxylic acid
CID 151585360
ethyl 1-benzyl-2-[(4-methylbenzoyl)amino]piperidine-4-carboxylate
CID 22359958
(2S)-1-benzyl-N-(thian-4-yl)piperidine-2-carboxamide
CID 97215907
methyl 1-benzylpiperidine-2-carboxylate
CID 10443988
N-(1-cyclopentylpyrrolidin-2-yl)benzamide
CID 90727034
1-benzyl-N-pyrrolidin-3-ylpiperidine-2-carboxamide
CID 119453078
1-benzyl-N-methylpyrrolidin-2-amine;hydrochloride
CID 172758906
N-[(2R)-1-benzoylpiperidin-2-yl]-4-methylbenzamide
CID 68592767
4-[(2S)-3-benzyl-4-oxo-1,3-thiazolidin-2-yl]-N-cyclopentylbenzamide
CID 40560076
1-benzyl-N-piperidin-3-ylpiperidine-2-carboxamide;dihydrochloride
CID 119427951
1-benzyl-N-cyclopentylpiperidine-4-carboxamide
CID 2186968

Frequently Asked Questions

What is the IUPAC name of N-(1-benzylpiperidin-2-yl)-4-hydroxybenzamide?
The IUPAC name of N-(1-benzylpiperidin-2-yl)-4-hydroxybenzamide (CID 141121427) is N-(1-benzylpiperidin-2-yl)-4-hydroxybenzamide.
What is the SMILES notation for N-(1-benzylpiperidin-2-yl)-4-hydroxybenzamide?
The canonical SMILES for N-(1-benzylpiperidin-2-yl)-4-hydroxybenzamide is O=C(NC1CCCCN1Cc1ccccc1)c1ccc(O)cc1.
What is the InChIKey of N-(1-benzylpiperidin-2-yl)-4-hydroxybenzamide?
The InChIKey is PUPUCYICJULHCZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H22N2O2/c22-17-11-9-16(10-12-17)19(23)20-18-8-4-5-13-21(18)14-15-6-2-1-3-7-15/h1-3,6-7,9-12,18,22H,4-5,8,13-14H2,(H,20,23).
What are the key properties of N-(1-benzylpiperidin-2-yl)-4-hydroxybenzamide?
N-(1-benzylpiperidin-2-yl)-4-hydroxybenzamide has a molecular weight of 310.40 g/mol, XLogP of 3.13, 4 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-(1-benzylpiperidin-2-yl)-4-hydroxybenzamide is sourced from PubChem (CID 141121427), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).