N-(3-chlorophenyl)-4-hydroxy-4-methylpiperidine-1-carboxamide

C13H17ClN2O2 — CID 23071915

IUPACN-(3-chlorophenyl)-4-hydroxy-4-methylpiperidine-1-carboxamide
SMILESCC1(O)CCN(C(=O)Nc2cccc(Cl)c2)CC1
InChIInChI=1S/C13H17ClN2O2/c1-13(18)5-7-16(8-6-13)12(17)15-11-4-2-3-10(14)9-11/h2-4,9,18H,5-8H2,1H3,(H,15,17)
InChIKeyRYMYGJHLOQRSFL-UHFFFAOYSA-N
MW268.74 g/mol
LogP2.72
Rot. Bonds1

About N-(3-chlorophenyl)-4-hydroxy-4-methylpiperidine-1-carboxamide

N-(3-chlorophenyl)-4-hydroxy-4-methylpiperidine-1-carboxamide (PubChem CID 23071915) has the molecular formula C13H17ClN2O2 and a molecular weight of 268.74 g/mol. Its IUPAC name is N-(3-chlorophenyl)-4-hydroxy-4-methylpiperidine-1-carboxamide.

Molecular Properties

Compound NameN-(3-chlorophenyl)-4-hydroxy-4-methylpiperidine-1-carboxamide
PubChem CID23071915
Molecular FormulaC13H17ClN2O2
Molecular Weight268.74 g/mol
Exact Mass268.10
IUPAC NameN-(3-chlorophenyl)-4-hydroxy-4-methylpiperidine-1-carboxamide
SMILESCC1(O)CCN(C(=O)Nc2cccc(Cl)c2)CC1
InChIInChI=1S/C13H17ClN2O2/c1-13(18)5-7-16(8-6-13)12(17)15-11-4-2-3-10(14)9-11/h2-4,9,18H,5-8H2,1H3,(H,15,17)
InChIKeyRYMYGJHLOQRSFL-UHFFFAOYSA-N
XLogP2.72
TPSA52.57 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds1
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500268.74
LogP ≤ 52.72
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

Analyze N-(3-chlorophenyl)-4-hydroxy-4-methylpiperidine-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

4-tert-butyl-N-(3-chlorophenyl)-4-hydroxypiperidine-1-carboxamide
CID 23071803
4-N-(3-chlorophenyl)-1-N-methylpiperazine-1,4-dicarboxamide
CID 23932887
N-(3-chloro-4-methylphenyl)-4-hydroxy-4-methylpiperidine-1-carboxamide
CID 80703460
N-[3-(aminomethyl)phenyl]-4-hydroxy-4-methylpiperidine-1-carboxamide
CID 81116359
N-(3-chlorophenyl)-3,9-diazaspiro[5.5]undecane-3-carboxamide;hydrochloride
CID 169490415
N-(3-chlorophenyl)-4-methylpiperidine-1-carboxamide
CID 707662
1-[(3-chlorophenyl)carbamoyl]-3-ethylpyrrolidine-3-carboxylic acid
CID 63145655
N-(3-chlorophenyl)-4-hydroxy-4-naphthalen-2-ylpiperidine-1-carboxamide
CID 23072023
N-(3-chlorophenyl)-4-propan-2-ylpiperidine-1-carboxamide
CID 59001093
3-hydroxy-3-methyl-N-(3-methylphenyl)pyrrolidine-1-carboxamide
CID 103727847
N-[(1R)-1-(3-chlorophenyl)ethyl]-4-hydroxy-4-methylpiperidine-1-carboxamide
CID 119049218
N-(3-chlorophenyl)-4-pyrimidin-2-ylpiperazine-1-carboxamide
CID 646916

Frequently Asked Questions

What is the IUPAC name of N-(3-chlorophenyl)-4-hydroxy-4-methylpiperidine-1-carboxamide?
The IUPAC name of N-(3-chlorophenyl)-4-hydroxy-4-methylpiperidine-1-carboxamide (CID 23071915) is N-(3-chlorophenyl)-4-hydroxy-4-methylpiperidine-1-carboxamide.
What is the SMILES notation for N-(3-chlorophenyl)-4-hydroxy-4-methylpiperidine-1-carboxamide?
The canonical SMILES for N-(3-chlorophenyl)-4-hydroxy-4-methylpiperidine-1-carboxamide is CC1(O)CCN(C(=O)Nc2cccc(Cl)c2)CC1.
What is the InChIKey of N-(3-chlorophenyl)-4-hydroxy-4-methylpiperidine-1-carboxamide?
The InChIKey is RYMYGJHLOQRSFL-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H17ClN2O2/c1-13(18)5-7-16(8-6-13)12(17)15-11-4-2-3-10(14)9-11/h2-4,9,18H,5-8H2,1H3,(H,15,17).
What are the key properties of N-(3-chlorophenyl)-4-hydroxy-4-methylpiperidine-1-carboxamide?
N-(3-chlorophenyl)-4-hydroxy-4-methylpiperidine-1-carboxamide has a molecular weight of 268.74 g/mol, XLogP of 2.72, 1 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-(3-chlorophenyl)-4-hydroxy-4-methylpiperidine-1-carboxamide is sourced from PubChem (CID 23071915), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).