5-(1-benzyl-3-methylpiperidin-3-yl)-N,N-dimethyl-1H-pyrazole-4-carboxamide

C19H26N4O — CID 110272328

IUPAC5-(1-benzyl-3-methylpiperidin-3-yl)-N,N-dimethyl-1H-pyrazole-4-carboxamide
SMILESCN(C)C(=O)c1cn[nH]c1C1(C)CCCN(Cc2ccccc2)C1
InChIInChI=1S/C19H26N4O/c1-19(17-16(12-20-21-17)18(24)22(2)3)10-7-11-23(14-19)13-15-8-5-4-6-9-15/h4-6,8-9,12H,7,10-11,13-14H2,1-3H3,(H,20,21)
InChIKeyVHIXGBPKDJZKPL-UHFFFAOYSA-N
MW326.44 g/mol
LogP2.67
Rot. Bonds4

About 5-(1-benzyl-3-methylpiperidin-3-yl)-N,N-dimethyl-1H-pyrazole-4-carboxamide

5-(1-benzyl-3-methylpiperidin-3-yl)-N,N-dimethyl-1H-pyrazole-4-carboxamide (PubChem CID 110272328) has the molecular formula C19H26N4O and a molecular weight of 326.44 g/mol. Its IUPAC name is 5-(1-benzyl-3-methylpiperidin-3-yl)-N,N-dimethyl-1H-pyrazole-4-carboxamide.

Molecular Properties

Compound Name5-(1-benzyl-3-methylpiperidin-3-yl)-N,N-dimethyl-1H-pyrazole-4-carboxamide
PubChem CID110272328
Molecular FormulaC19H26N4O
Molecular Weight326.44 g/mol
Exact Mass326.21
IUPAC Name5-(1-benzyl-3-methylpiperidin-3-yl)-N,N-dimethyl-1H-pyrazole-4-carboxamide
SMILESCN(C)C(=O)c1cn[nH]c1C1(C)CCCN(Cc2ccccc2)C1
InChIInChI=1S/C19H26N4O/c1-19(17-16(12-20-21-17)18(24)22(2)3)10-7-11-23(14-19)13-15-8-5-4-6-9-15/h4-6,8-9,12H,7,10-11,13-14H2,1-3H3,(H,20,21)
InChIKeyVHIXGBPKDJZKPL-UHFFFAOYSA-N
XLogP2.67
TPSA52.23 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500326.44
LogP ≤ 52.67
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Analyze 5-(1-benzyl-3-methylpiperidin-3-yl)-N,N-dimethyl-1H-pyrazole-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

4-[[3-methyl-3-(4-methylsulfonyl-1H-pyrazol-5-yl)piperidin-1-yl]methyl]phenol
CID 110272355
N,N-dimethyl-5-[4-methyl-1-[(3-methylimidazol-4-yl)methyl]piperidin-4-yl]-1H-pyrazole-4-carboxamide
CID 95848683
[(6S)-8-benzyl-2,8-diazaspiro[5.5]undecan-2-yl]-(5-ethyl-1H-pyrazol-4-yl)methanone
CID 95869845
1-benzyl-3-methylpiperidin-3-ol
CID 15283107
N-benzyl-5-[(3S)-1-benzylpiperidin-3-yl]-N-methyl-1H-pyrazole-4-carboxamide
CID 95805298
2-[(3R)-3-methyl-3-(4-methylsulfonyl-1H-pyrazol-5-yl)piperidin-1-yl]acetamide
CID 125000035
2-[4-[[2-methyl-2-(4-methyl-1H-pyrazol-5-yl)morpholin-4-yl]methyl]phenyl]benzoic acid
CID 110097245
1-benzyl-3-(methylamino)piperidine-3-carboxylic acid
CID 43753689
(3S)-1-benzyl-3-methylpiperidine-3-thiol
CID 97176105
1-benzyl-3-fluoro-3-methylpiperidine
CID 136545779
(3S)-1-benzyl-3-bromo-3-methylpiperidine
CID 97176093
(3S)-N,N,3-trimethyl-1-(pyridin-4-ylmethyl)piperidine-3-carboxamide
CID 124989292

Frequently Asked Questions

What is the IUPAC name of 5-(1-benzyl-3-methylpiperidin-3-yl)-N,N-dimethyl-1H-pyrazole-4-carboxamide?
The IUPAC name of 5-(1-benzyl-3-methylpiperidin-3-yl)-N,N-dimethyl-1H-pyrazole-4-carboxamide (CID 110272328) is 5-(1-benzyl-3-methylpiperidin-3-yl)-N,N-dimethyl-1H-pyrazole-4-carboxamide.
What is the SMILES notation for 5-(1-benzyl-3-methylpiperidin-3-yl)-N,N-dimethyl-1H-pyrazole-4-carboxamide?
The canonical SMILES for 5-(1-benzyl-3-methylpiperidin-3-yl)-N,N-dimethyl-1H-pyrazole-4-carboxamide is CN(C)C(=O)c1cn[nH]c1C1(C)CCCN(Cc2ccccc2)C1.
What is the InChIKey of 5-(1-benzyl-3-methylpiperidin-3-yl)-N,N-dimethyl-1H-pyrazole-4-carboxamide?
The InChIKey is VHIXGBPKDJZKPL-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H26N4O/c1-19(17-16(12-20-21-17)18(24)22(2)3)10-7-11-23(14-19)13-15-8-5-4-6-9-15/h4-6,8-9,12H,7,10-11,13-14H2,1-3H3,(H,20,21).
What are the key properties of 5-(1-benzyl-3-methylpiperidin-3-yl)-N,N-dimethyl-1H-pyrazole-4-carboxamide?
5-(1-benzyl-3-methylpiperidin-3-yl)-N,N-dimethyl-1H-pyrazole-4-carboxamide has a molecular weight of 326.44 g/mol, XLogP of 2.67, 4 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 5-(1-benzyl-3-methylpiperidin-3-yl)-N,N-dimethyl-1H-pyrazole-4-carboxamide is sourced from PubChem (CID 110272328), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).