N-(2,3-dimethylphenyl)piperidine-4-carboxamide;hydrochloride

C14H21ClN2O — CID 119261898

IUPACN-(2,3-dimethylphenyl)piperidine-4-carboxamide;hydrochloride
SMILESCc1cccc(NC(=O)C2CCNCC2)c1C.Cl
InChIInChI=1S/C14H20N2O.ClH/c1-10-4-3-5-13(11(10)2)16-14(17)12-6-8-15-9-7-12;/h3-5,12,15H,6-9H2,1-2H3,(H,16,17);1H
InChIKeyURQNEYDPTVVSPO-UHFFFAOYSA-N
MW268.79 g/mol
LogP2.66
Rot. Bonds2

About N-(2,3-dimethylphenyl)piperidine-4-carboxamide;hydrochloride

N-(2,3-dimethylphenyl)piperidine-4-carboxamide;hydrochloride (PubChem CID 119261898) has the molecular formula C14H21ClN2O and a molecular weight of 268.79 g/mol. Its IUPAC name is N-(2,3-dimethylphenyl)piperidine-4-carboxamide;hydrochloride.

Molecular Properties

Compound NameN-(2,3-dimethylphenyl)piperidine-4-carboxamide;hydrochloride
PubChem CID119261898
Molecular FormulaC14H21ClN2O
Molecular Weight268.79 g/mol
Exact Mass268.13
IUPAC NameN-(2,3-dimethylphenyl)piperidine-4-carboxamide;hydrochloride
SMILESCc1cccc(NC(=O)C2CCNCC2)c1C.Cl
InChIInChI=1S/C14H20N2O.ClH/c1-10-4-3-5-13(11(10)2)16-14(17)12-6-8-15-9-7-12;/h3-5,12,15H,6-9H2,1-2H3,(H,16,17);1H
InChIKeyURQNEYDPTVVSPO-UHFFFAOYSA-N
XLogP2.66
TPSA41.13 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500268.79
LogP ≤ 52.66
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

Analyze N-(2,3-dimethylphenyl)piperidine-4-carboxamide;hydrochloride 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-(2,3-dimethylphenyl)pyrrolidine-3-carboxamide;hydrochloride
CID 119670575
N-(3-fluoro-2-methylphenyl)piperidine-4-carboxamide;hydrochloride
CID 119281807
N-(2,3-dimethylphenyl)oxane-4-carboxamide
CID 31962553
N-[3-methyl-2-(pyrrolidine-1-carbonyl)phenyl]piperidine-4-carboxamide
CID 119285186
(3R)-N-(2-methylphenyl)pyrrolidine-3-carboxamide
CID 94915623
(2S)-N-(2,3-dimethylphenyl)pyrrolidine-2-carboxamide;hydrochloride
CID 119261902
N-[2-methyl-3-(propylsulfonylamino)phenyl]piperidine-4-carboxamide
CID 119301618
N-(2-methylsulfanylphenyl)piperidine-4-carboxamide;hydrochloride
CID 119263530
N-(3-bromo-2-methylphenyl)pyrrolidine-3-carboxamide
CID 103808589
N-[1-(2,3-dimethylphenyl)ethyl]piperidine-4-carboxamide
CID 119327095
1-N-cyclohexyl-4-N-(2,3-dimethylphenyl)cyclohexane-1,4-dicarboxamide
CID 109146152
N-(2,5-dimethylphenyl)piperidine-4-carboxamide
CID 18073176

Frequently Asked Questions

What is the IUPAC name of N-(2,3-dimethylphenyl)piperidine-4-carboxamide;hydrochloride?
The IUPAC name of N-(2,3-dimethylphenyl)piperidine-4-carboxamide;hydrochloride (CID 119261898) is N-(2,3-dimethylphenyl)piperidine-4-carboxamide;hydrochloride.
What is the SMILES notation for N-(2,3-dimethylphenyl)piperidine-4-carboxamide;hydrochloride?
The canonical SMILES for N-(2,3-dimethylphenyl)piperidine-4-carboxamide;hydrochloride is Cc1cccc(NC(=O)C2CCNCC2)c1C.Cl.
What is the InChIKey of N-(2,3-dimethylphenyl)piperidine-4-carboxamide;hydrochloride?
The InChIKey is URQNEYDPTVVSPO-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H20N2O.ClH/c1-10-4-3-5-13(11(10)2)16-14(17)12-6-8-15-9-7-12;/h3-5,12,15H,6-9H2,1-2H3,(H,16,17);1H.
What are the key properties of N-(2,3-dimethylphenyl)piperidine-4-carboxamide;hydrochloride?
N-(2,3-dimethylphenyl)piperidine-4-carboxamide;hydrochloride has a molecular weight of 268.79 g/mol, XLogP of 2.66, 2 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2,3-dimethylphenyl)piperidine-4-carboxamide;hydrochloride is sourced from PubChem (CID 119261898), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).