N-methyl-1-(2-methylphenyl)-N-[(3R)-pyrrolidin-3-yl]pyrazole-4-carboxamide

C16H20N4O — CID 125134433

IUPACN-methyl-1-(2-methylphenyl)-N-[(3R)-pyrrolidin-3-yl]pyrazole-4-carboxamide
SMILESCc1ccccc1-n1cc(C(=O)N(C)[C@@H]2CCNC2)cn1
InChIInChI=1S/C16H20N4O/c1-12-5-3-4-6-15(12)20-11-13(9-18-20)16(21)19(2)14-7-8-17-10-14/h3-6,9,11,14,17H,7-8,10H2,1-2H3/t14-/m1/s1
InChIKeyDGHUNQVWJFLJRW-CQSZACIVSA-N
MW284.36 g/mol
LogP1.61
Rot. Bonds3

About N-methyl-1-(2-methylphenyl)-N-[(3R)-pyrrolidin-3-yl]pyrazole-4-carboxamide

N-methyl-1-(2-methylphenyl)-N-[(3R)-pyrrolidin-3-yl]pyrazole-4-carboxamide (PubChem CID 125134433) has the molecular formula C16H20N4O and a molecular weight of 284.36 g/mol. Its IUPAC name is N-methyl-1-(2-methylphenyl)-N-[(3R)-pyrrolidin-3-yl]pyrazole-4-carboxamide.

Molecular Properties

Compound NameN-methyl-1-(2-methylphenyl)-N-[(3R)-pyrrolidin-3-yl]pyrazole-4-carboxamide
PubChem CID125134433
Molecular FormulaC16H20N4O
Molecular Weight284.36 g/mol
Exact Mass284.16
IUPAC NameN-methyl-1-(2-methylphenyl)-N-[(3R)-pyrrolidin-3-yl]pyrazole-4-carboxamide
SMILESCc1ccccc1-n1cc(C(=O)N(C)[C@@H]2CCNC2)cn1
InChIInChI=1S/C16H20N4O/c1-12-5-3-4-6-15(12)20-11-13(9-18-20)16(21)19(2)14-7-8-17-10-14/h3-6,9,11,14,17H,7-8,10H2,1-2H3/t14-/m1/s1
InChIKeyDGHUNQVWJFLJRW-CQSZACIVSA-N
XLogP1.61
TPSA50.16 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500284.36
LogP ≤ 51.61
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

Analyze N-methyl-1-(2-methylphenyl)-N-[(3R)-pyrrolidin-3-yl]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

N-methyl-1-(2-methylphenyl)-N-[(3S)-pyrrolidin-3-yl]pyrazole-4-carboxamide
CID 125134432
1-(2,4-dichlorophenyl)-N-methyl-N-pyrrolidin-3-ylpyrazole-4-carboxamide
CID 119554673
N-methyl-1-phenyl-N-piperidin-4-ylpyrazole-4-carboxamide
CID 43602271
1-tert-butyl-N-methyl-N-pyrrolidin-3-ylpyrazole-4-carboxamide;hydrochloride
CID 119550148
N-methyl-1-(2-methylphenyl)-N-pyrrolidin-3-yl-5,6-dihydro-4H-cyclopenta[d]pyrazole-3-carboxamide;hydrochloride
CID 119554064
1-(2-methylphenyl)-4-pyrrolidin-3-ylpyrazole
CID 105484973
N,2,5-trimethyl-1-(2-methylphenyl)-N-pyrrolidin-3-ylpyrrole-3-carboxamide
CID 119554350
3-fluoro-N-methyl-N-pyrrolidin-3-ylbenzamide
CID 60805996
N-methyl-2-(2-methylphenyl)-N-pyrrolidin-3-ylacetamide;hydrochloride
CID 119260686
N,3,4-trimethyl-N-pyrrolidin-3-ylbenzamide;hydrochloride
CID 119554368
N-methyl-N-pyrrolidin-3-ylpyridine-4-carboxamide;dihydrochloride
CID 119551120
N-methyl-5-phenyl-N-pyrrolidin-3-ylpyridine-3-carboxamide
CID 119552362

Frequently Asked Questions

What is the IUPAC name of N-methyl-1-(2-methylphenyl)-N-[(3R)-pyrrolidin-3-yl]pyrazole-4-carboxamide?
The IUPAC name of N-methyl-1-(2-methylphenyl)-N-[(3R)-pyrrolidin-3-yl]pyrazole-4-carboxamide (CID 125134433) is N-methyl-1-(2-methylphenyl)-N-[(3R)-pyrrolidin-3-yl]pyrazole-4-carboxamide.
What is the SMILES notation for N-methyl-1-(2-methylphenyl)-N-[(3R)-pyrrolidin-3-yl]pyrazole-4-carboxamide?
The canonical SMILES for N-methyl-1-(2-methylphenyl)-N-[(3R)-pyrrolidin-3-yl]pyrazole-4-carboxamide is Cc1ccccc1-n1cc(C(=O)N(C)[C@@H]2CCNC2)cn1.
What is the InChIKey of N-methyl-1-(2-methylphenyl)-N-[(3R)-pyrrolidin-3-yl]pyrazole-4-carboxamide?
The InChIKey is DGHUNQVWJFLJRW-CQSZACIVSA-N. The full InChI is InChI=1S/C16H20N4O/c1-12-5-3-4-6-15(12)20-11-13(9-18-20)16(21)19(2)14-7-8-17-10-14/h3-6,9,11,14,17H,7-8,10H2,1-2H3/t14-/m1/s1.
What are the key properties of N-methyl-1-(2-methylphenyl)-N-[(3R)-pyrrolidin-3-yl]pyrazole-4-carboxamide?
N-methyl-1-(2-methylphenyl)-N-[(3R)-pyrrolidin-3-yl]pyrazole-4-carboxamide has a molecular weight of 284.36 g/mol, XLogP of 1.61, 3 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-methyl-1-(2-methylphenyl)-N-[(3R)-pyrrolidin-3-yl]pyrazole-4-carboxamide is sourced from PubChem (CID 125134433), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).