1-[(2-chlorophenyl)methyl]-N,N-dimethyl-4-[(2-methylpyrazol-3-yl)amino]piperidine-4-carboxamide

C19H26ClN5O — CID 155878918

IUPAC1-[(2-chlorophenyl)methyl]-N,N-dimethyl-4-[(2-methylpyrazol-3-yl)amino]piperidine-4-carboxamide
SMILESCN(C)C(=O)C1(Nc2ccnn2C)CCN(Cc2ccccc2Cl)CC1
InChIInChI=1S/C19H26ClN5O/c1-23(2)18(26)19(22-17-8-11-21-24(17)3)9-12-25(13-10-19)14-15-6-4-5-7-16(15)20/h4-8,11,22H,9-10,12-14H2,1-3H3
InChIKeyRCILMVZYRLBAMV-UHFFFAOYSA-N
MW375.90 g/mol
LogP2.61
Rot. Bonds5

About 1-[(2-chlorophenyl)methyl]-N,N-dimethyl-4-[(2-methylpyrazol-3-yl)amino]piperidine-4-carboxamide

1-[(2-chlorophenyl)methyl]-N,N-dimethyl-4-[(2-methylpyrazol-3-yl)amino]piperidine-4-carboxamide (PubChem CID 155878918) has the molecular formula C19H26ClN5O and a molecular weight of 375.90 g/mol. Its IUPAC name is 1-[(2-chlorophenyl)methyl]-N,N-dimethyl-4-[(2-methylpyrazol-3-yl)amino]piperidine-4-carboxamide.

Molecular Properties

Compound Name1-[(2-chlorophenyl)methyl]-N,N-dimethyl-4-[(2-methylpyrazol-3-yl)amino]piperidine-4-carboxamide
PubChem CID155878918
Molecular FormulaC19H26ClN5O
Molecular Weight375.90 g/mol
Exact Mass375.18
IUPAC Name1-[(2-chlorophenyl)methyl]-N,N-dimethyl-4-[(2-methylpyrazol-3-yl)amino]piperidine-4-carboxamide
SMILESCN(C)C(=O)C1(Nc2ccnn2C)CCN(Cc2ccccc2Cl)CC1
InChIInChI=1S/C19H26ClN5O/c1-23(2)18(26)19(22-17-8-11-21-24(17)3)9-12-25(13-10-19)14-15-6-4-5-7-16(15)20/h4-8,11,22H,9-10,12-14H2,1-3H3
InChIKeyRCILMVZYRLBAMV-UHFFFAOYSA-N
XLogP2.61
TPSA53.40 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds5
Heavy Atoms26
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500375.90
LogP ≤ 52.61
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

Analyze 1-[(2-chlorophenyl)methyl]-N,N-dimethyl-4-[(2-methylpyrazol-3-yl)amino]piperidine-4-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

1-[(3-chlorophenyl)methyl]-N,N-dimethyl-4-[(2-methylpyrazol-3-yl)amino]piperidine-4-carboxamide
CID 155879157
N,N-dimethyl-4-[(2-methylpyrazol-3-yl)amino]-1-(2-pyridin-2-ylacetyl)piperidine-4-carboxamide;formic acid
CID 155879891
4-anilino-1-[(2-fluorophenyl)methyl]-N,N-dimethylpiperidine-4-carboxamide
CID 155879946
4-anilino-1-[(2-methoxyphenyl)methyl]-N,N-dimethylpiperidine-4-carboxamide
CID 155878897
1-[(2-chlorophenyl)methyl]-N,N-dimethyl-3-pyrazol-1-ylpiperidine-3-carboxamide
CID 155878950
1-[(2-chlorophenyl)methyl]-4-imidazol-1-yl-N,N-dimethylpiperidine-4-carboxamide;formic acid
CID 171695756
4-anilino-N,N-dimethyl-1-(2-methylpyrazole-3-carbonyl)piperidine-4-carboxamide
CID 155874172
N-[[1-[(2-chlorophenyl)methyl]piperidin-4-yl]methyl]-2-methylpyrazole-3-carboxamide
CID 136524248
4-(3-fluoroanilino)-N,N-dimethyl-1-[(2-methylphenyl)methyl]piperidine-4-carboxamide
CID 155873984
3-[9-[(2-chlorophenyl)methyl]-1-oxa-9-azaspiro[5.5]undecan-4-yl]-1,1-dimethylurea
CID 131661376
1-[(2-chlorophenyl)methyl]-N,4-dimethyl-N-[4-(2,2,2-trifluoroethyl)phenyl]piperidine-4-carboxamide
CID 70791961
N-[[1-[(2-chlorophenyl)methyl]piperidin-4-yl]methylideneamino]-N-methylpyridine-2-carboxamide
CID 175108337

Frequently Asked Questions

What is the IUPAC name of 1-[(2-chlorophenyl)methyl]-N,N-dimethyl-4-[(2-methylpyrazol-3-yl)amino]piperidine-4-carboxamide?
The IUPAC name of 1-[(2-chlorophenyl)methyl]-N,N-dimethyl-4-[(2-methylpyrazol-3-yl)amino]piperidine-4-carboxamide (CID 155878918) is 1-[(2-chlorophenyl)methyl]-N,N-dimethyl-4-[(2-methylpyrazol-3-yl)amino]piperidine-4-carboxamide.
What is the SMILES notation for 1-[(2-chlorophenyl)methyl]-N,N-dimethyl-4-[(2-methylpyrazol-3-yl)amino]piperidine-4-carboxamide?
The canonical SMILES for 1-[(2-chlorophenyl)methyl]-N,N-dimethyl-4-[(2-methylpyrazol-3-yl)amino]piperidine-4-carboxamide is CN(C)C(=O)C1(Nc2ccnn2C)CCN(Cc2ccccc2Cl)CC1.
What is the InChIKey of 1-[(2-chlorophenyl)methyl]-N,N-dimethyl-4-[(2-methylpyrazol-3-yl)amino]piperidine-4-carboxamide?
The InChIKey is RCILMVZYRLBAMV-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H26ClN5O/c1-23(2)18(26)19(22-17-8-11-21-24(17)3)9-12-25(13-10-19)14-15-6-4-5-7-16(15)20/h4-8,11,22H,9-10,12-14H2,1-3H3.
What are the key properties of 1-[(2-chlorophenyl)methyl]-N,N-dimethyl-4-[(2-methylpyrazol-3-yl)amino]piperidine-4-carboxamide?
1-[(2-chlorophenyl)methyl]-N,N-dimethyl-4-[(2-methylpyrazol-3-yl)amino]piperidine-4-carboxamide has a molecular weight of 375.90 g/mol, XLogP of 2.61, 5 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 1-[(2-chlorophenyl)methyl]-N,N-dimethyl-4-[(2-methylpyrazol-3-yl)amino]piperidine-4-carboxamide is sourced from PubChem (CID 155878918), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).