N-(1-benzylpiperidin-3-yl)-2-hydroxy-5-methylbenzamide

C20H24N2O2 — CID 75874280

IUPACN-(1-benzylpiperidin-3-yl)-2-hydroxy-5-methylbenzamide
SMILESCc1ccc(O)c(C(=O)NC2CCCN(Cc3ccccc3)C2)c1
InChIInChI=1S/C20H24N2O2/c1-15-9-10-19(23)18(12-15)20(24)21-17-8-5-11-22(14-17)13-16-6-3-2-4-7-16/h2-4,6-7,9-10,12,17,23H,5,8,11,13-14H2,1H3,(H,21,24)
InChIKeyOANHCPXYDVYAPA-UHFFFAOYSA-N
MW324.42 g/mol
LogP3.10
Rot. Bonds4

About N-(1-benzylpiperidin-3-yl)-2-hydroxy-5-methylbenzamide

N-(1-benzylpiperidin-3-yl)-2-hydroxy-5-methylbenzamide (PubChem CID 75874280) has the molecular formula C20H24N2O2 and a molecular weight of 324.42 g/mol. Its IUPAC name is N-(1-benzylpiperidin-3-yl)-2-hydroxy-5-methylbenzamide.

Molecular Properties

Compound NameN-(1-benzylpiperidin-3-yl)-2-hydroxy-5-methylbenzamide
PubChem CID75874280
Molecular FormulaC20H24N2O2
Molecular Weight324.42 g/mol
Exact Mass324.18
IUPAC NameN-(1-benzylpiperidin-3-yl)-2-hydroxy-5-methylbenzamide
SMILESCc1ccc(O)c(C(=O)NC2CCCN(Cc3ccccc3)C2)c1
InChIInChI=1S/C20H24N2O2/c1-15-9-10-19(23)18(12-15)20(24)21-17-8-5-11-22(14-17)13-16-6-3-2-4-7-16/h2-4,6-7,9-10,12,17,23H,5,8,11,13-14H2,1H3,(H,21,24)
InChIKeyOANHCPXYDVYAPA-UHFFFAOYSA-N
XLogP3.10
TPSA52.57 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500324.42
LogP ≤ 53.10
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

N-(1-ethylpiperidin-3-yl)-2-hydroxy-5-methylbenzamide
CID 47344801
N-(1-benzylpyrrolidin-3-yl)-2-hydroxy-4-methylbenzamide
CID 55376410
N-(1-benzylpiperidin-3-yl)-2-methylbenzamide
CID 42958722
N-(1-benzylpyrrolidin-3-yl)-2,4-dimethylbenzamide
CID 18156319
N-(1-benzylpiperidin-3-yl)-2-methylquinoline-3-carboxamide
CID 86981138
N-[(3S)-1-benzylpiperidin-3-yl]acetamide
CID 58526543
1-(1-benzylpiperidin-3-yl)-3-cyclobutylurea
CID 115617829
2-chloro-N-[1-[[4-(3,5-dimethylphenyl)phenyl]methyl]piperidin-3-yl]benzamide
CID 134802067
N-(1-benzylpiperidin-3-yl)-2-bromo-5-fluorobenzamide
CID 42958717
N-[1-[[4-(3,5-dimethylphenyl)phenyl]methyl]piperidin-3-yl]benzamide
CID 134801576
N-(1-benzylpiperidin-3-yl)-2,5-dimethyl-1-(1,3-thiazol-2-yl)pyrrole-3-carboxamide
CID 78897706
N-(1-benzylpyrrolidin-3-yl)-4-(2,5-dimethylphenyl)-4-oxobutanamide
CID 55378288

Frequently Asked Questions

What is the IUPAC name of N-(1-benzylpiperidin-3-yl)-2-hydroxy-5-methylbenzamide?
The IUPAC name of N-(1-benzylpiperidin-3-yl)-2-hydroxy-5-methylbenzamide (CID 75874280) is N-(1-benzylpiperidin-3-yl)-2-hydroxy-5-methylbenzamide.
What is the SMILES notation for N-(1-benzylpiperidin-3-yl)-2-hydroxy-5-methylbenzamide?
The canonical SMILES for N-(1-benzylpiperidin-3-yl)-2-hydroxy-5-methylbenzamide is Cc1ccc(O)c(C(=O)NC2CCCN(Cc3ccccc3)C2)c1.
What is the InChIKey of N-(1-benzylpiperidin-3-yl)-2-hydroxy-5-methylbenzamide?
The InChIKey is OANHCPXYDVYAPA-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H24N2O2/c1-15-9-10-19(23)18(12-15)20(24)21-17-8-5-11-22(14-17)13-16-6-3-2-4-7-16/h2-4,6-7,9-10,12,17,23H,5,8,11,13-14H2,1H3,(H,21,24).
What are the key properties of N-(1-benzylpiperidin-3-yl)-2-hydroxy-5-methylbenzamide?
N-(1-benzylpiperidin-3-yl)-2-hydroxy-5-methylbenzamide has a molecular weight of 324.42 g/mol, XLogP of 3.10, 4 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-(1-benzylpiperidin-3-yl)-2-hydroxy-5-methylbenzamide is sourced from PubChem (CID 75874280), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).