N-(2,5-dimethylphenyl)-3-(hydroxymethyl)piperidine-1-carboxamide

C15H22N2O2 — CID 84528566

IUPACN-(2,5-dimethylphenyl)-3-(hydroxymethyl)piperidine-1-carboxamide
SMILESCc1ccc(C)c(NC(=O)N2CCCC(CO)C2)c1
InChIInChI=1S/C15H22N2O2/c1-11-5-6-12(2)14(8-11)16-15(19)17-7-3-4-13(9-17)10-18/h5-6,8,13,18H,3-4,7,9-10H2,1-2H3,(H,16,19)
InChIKeyIGBRGCMDFPNPKQ-UHFFFAOYSA-N
MW262.35 g/mol
LogP2.54
Rot. Bonds2

About N-(2,5-dimethylphenyl)-3-(hydroxymethyl)piperidine-1-carboxamide

N-(2,5-dimethylphenyl)-3-(hydroxymethyl)piperidine-1-carboxamide (PubChem CID 84528566) has the molecular formula C15H22N2O2 and a molecular weight of 262.35 g/mol. Its IUPAC name is N-(2,5-dimethylphenyl)-3-(hydroxymethyl)piperidine-1-carboxamide.

Molecular Properties

Compound NameN-(2,5-dimethylphenyl)-3-(hydroxymethyl)piperidine-1-carboxamide
PubChem CID84528566
Molecular FormulaC15H22N2O2
Molecular Weight262.35 g/mol
Exact Mass262.17
IUPAC NameN-(2,5-dimethylphenyl)-3-(hydroxymethyl)piperidine-1-carboxamide
SMILESCc1ccc(C)c(NC(=O)N2CCCC(CO)C2)c1
InChIInChI=1S/C15H22N2O2/c1-11-5-6-12(2)14(8-11)16-15(19)17-7-3-4-13(9-17)10-18/h5-6,8,13,18H,3-4,7,9-10H2,1-2H3,(H,16,19)
InChIKeyIGBRGCMDFPNPKQ-UHFFFAOYSA-N
XLogP2.54
TPSA52.57 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500262.35
LogP ≤ 52.54
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

Analyze N-(2,5-dimethylphenyl)-3-(hydroxymethyl)piperidine-1-carboxamide with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

N-(2,5-dimethylphenyl)-2-[3-(hydroxymethyl)piperidin-1-yl]propanamide
CID 110880134
3-(hydroxymethyl)-N-[2-methyl-5-(2,2,2-trifluoroethylcarbamoyl)phenyl]piperidine-1-carboxamide
CID 86994889
2-[1-[(2,4-dimethylphenyl)carbamoyl]piperidin-3-yl]acetic acid
CID 62690811
(4aS,8aR)-N-(2,5-dimethylphenyl)-3,4,4a,5,6,7,8,8a-octahydro-1H-isoquinoline-2-carboxamide
CID 51943981
N-(2,5-dimethylphenyl)-3-(imidazo[4,5-b]pyridin-3-ylmethyl)piperidine-1-carboxamide
CID 91904171
N-(4-bromo-2,6-dimethylphenyl)-3-(hydroxymethyl)piperidine-1-carboxamide
CID 110892772
2-(2,5-dimethylphenyl)sulfanyl-1-[3-(hydroxymethyl)piperidin-1-yl]ethanone
CID 43403143
(3S)-N-(2,5-dimethylphenyl)-3-(morpholine-4-carbonyl)piperidine-1-carboxamide
CID 95298396
N-(2,4-dimethylphenyl)-3-[(propanoylamino)methyl]piperidine-1-carboxamide
CID 71840485
3-(hydroxymethyl)-N-(2-propan-2-ylphenyl)piperidine-1-carboxamide
CID 84529064
N-(2,5-dimethylphenyl)-4-[[(3S,5S)-3,5-dimethylpiperidin-1-yl]methyl]piperidine-1-carboxamide
CID 92731340
methyl 4-methyl-3-[[3-(methylsulfanylmethyl)piperidine-1-carbonyl]amino]benzoate
CID 72889185

Frequently Asked Questions

What is the IUPAC name of N-(2,5-dimethylphenyl)-3-(hydroxymethyl)piperidine-1-carboxamide?
The IUPAC name of N-(2,5-dimethylphenyl)-3-(hydroxymethyl)piperidine-1-carboxamide (CID 84528566) is N-(2,5-dimethylphenyl)-3-(hydroxymethyl)piperidine-1-carboxamide.
What is the SMILES notation for N-(2,5-dimethylphenyl)-3-(hydroxymethyl)piperidine-1-carboxamide?
The canonical SMILES for N-(2,5-dimethylphenyl)-3-(hydroxymethyl)piperidine-1-carboxamide is Cc1ccc(C)c(NC(=O)N2CCCC(CO)C2)c1.
What is the InChIKey of N-(2,5-dimethylphenyl)-3-(hydroxymethyl)piperidine-1-carboxamide?
The InChIKey is IGBRGCMDFPNPKQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H22N2O2/c1-11-5-6-12(2)14(8-11)16-15(19)17-7-3-4-13(9-17)10-18/h5-6,8,13,18H,3-4,7,9-10H2,1-2H3,(H,16,19).
What are the key properties of N-(2,5-dimethylphenyl)-3-(hydroxymethyl)piperidine-1-carboxamide?
N-(2,5-dimethylphenyl)-3-(hydroxymethyl)piperidine-1-carboxamide has a molecular weight of 262.35 g/mol, XLogP of 2.54, 2 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2,5-dimethylphenyl)-3-(hydroxymethyl)piperidine-1-carboxamide is sourced from PubChem (CID 84528566), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).