1-(2-methylphenyl)-N-[(2R)-1-(2-oxopyrrolidin-1-yl)propan-2-yl]pyrazole-4-carboxamide

C18H22N4O2 — CID 95316080

IUPAC1-(2-methylphenyl)-N-[(2R)-1-(2-oxopyrrolidin-1-yl)propan-2-yl]pyrazole-4-carboxamide
SMILESCc1ccccc1-n1cc(C(=O)N[C@H](C)CN2CCCC2=O)cn1
InChIInChI=1S/C18H22N4O2/c1-13-6-3-4-7-16(13)22-12-15(10-19-22)18(24)20-14(2)11-21-9-5-8-17(21)23/h3-4,6-7,10,12,14H,5,8-9,11H2,1-2H3,(H,20,24)/t14-/m1/s1
InChIKeyWNEKLQOYKABMAU-CQSZACIVSA-N
MW326.40 g/mol
LogP1.92
Rot. Bonds5

About 1-(2-methylphenyl)-N-[(2R)-1-(2-oxopyrrolidin-1-yl)propan-2-yl]pyrazole-4-carboxamide

1-(2-methylphenyl)-N-[(2R)-1-(2-oxopyrrolidin-1-yl)propan-2-yl]pyrazole-4-carboxamide (PubChem CID 95316080) has the molecular formula C18H22N4O2 and a molecular weight of 326.40 g/mol. Its IUPAC name is 1-(2-methylphenyl)-N-[(2R)-1-(2-oxopyrrolidin-1-yl)propan-2-yl]pyrazole-4-carboxamide.

Molecular Properties

Compound Name1-(2-methylphenyl)-N-[(2R)-1-(2-oxopyrrolidin-1-yl)propan-2-yl]pyrazole-4-carboxamide
PubChem CID95316080
Molecular FormulaC18H22N4O2
Molecular Weight326.40 g/mol
Exact Mass326.17
IUPAC Name1-(2-methylphenyl)-N-[(2R)-1-(2-oxopyrrolidin-1-yl)propan-2-yl]pyrazole-4-carboxamide
SMILESCc1ccccc1-n1cc(C(=O)N[C@H](C)CN2CCCC2=O)cn1
InChIInChI=1S/C18H22N4O2/c1-13-6-3-4-7-16(13)22-12-15(10-19-22)18(24)20-14(2)11-21-9-5-8-17(21)23/h3-4,6-7,10,12,14H,5,8-9,11H2,1-2H3,(H,20,24)/t14-/m1/s1
InChIKeyWNEKLQOYKABMAU-CQSZACIVSA-N
XLogP1.92
TPSA67.23 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500326.40
LogP ≤ 51.92
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

Analyze 1-(2-methylphenyl)-N-[(2R)-1-(2-oxopyrrolidin-1-yl)propan-2-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

5-bromo-N-[1-(2-oxopyrrolidin-1-yl)propan-2-yl]thiophene-3-carboxamide
CID 47267922
2-[[1-(2-methylphenyl)pyrazole-4-carbonyl]amino]butanoic acid
CID 119223849
1-(2-methylphenyl)-N-[[(2R)-6-oxopiperidin-2-yl]methyl]pyrazole-4-carboxamide
CID 154844458
3-(chloromethyl)-N-[1-(2-oxopyrrolidin-1-yl)propan-2-yl]benzamide
CID 60934371
4-(aminomethyl)-N-[1-(2-oxopyrrolidin-1-yl)propan-2-yl]benzamide
CID 60928640
N-[1-(2-oxopyrrolidin-1-yl)propan-2-yl]thiophene-2-carboxamide
CID 61062526
(2S)-2-[[1-(2-methylphenyl)pyrazole-4-carbonyl]amino]hexanoic acid
CID 120615352
N-[1-(2-oxopyrrolidin-1-yl)propan-2-yl]-2H-triazole-4-carboxamide
CID 112733895
3-bromo-2-methyl-N-[(2R)-1-(2-oxopyrrolidin-1-yl)propan-2-yl]benzamide
CID 97054372
4-fluoro-2-methyl-N-[1-(2-oxopyrrolidin-1-yl)propan-2-yl]benzamide
CID 115745779
6-oxo-N-[1-(2-oxopyrrolidin-1-yl)propan-2-yl]-1H-pyridine-2-carboxamide
CID 107362990
4-amino-3-fluoro-N-[1-(2-oxopyrrolidin-1-yl)propan-2-yl]benzamide
CID 62678143

Frequently Asked Questions

What is the IUPAC name of 1-(2-methylphenyl)-N-[(2R)-1-(2-oxopyrrolidin-1-yl)propan-2-yl]pyrazole-4-carboxamide?
The IUPAC name of 1-(2-methylphenyl)-N-[(2R)-1-(2-oxopyrrolidin-1-yl)propan-2-yl]pyrazole-4-carboxamide (CID 95316080) is 1-(2-methylphenyl)-N-[(2R)-1-(2-oxopyrrolidin-1-yl)propan-2-yl]pyrazole-4-carboxamide.
What is the SMILES notation for 1-(2-methylphenyl)-N-[(2R)-1-(2-oxopyrrolidin-1-yl)propan-2-yl]pyrazole-4-carboxamide?
The canonical SMILES for 1-(2-methylphenyl)-N-[(2R)-1-(2-oxopyrrolidin-1-yl)propan-2-yl]pyrazole-4-carboxamide is Cc1ccccc1-n1cc(C(=O)N[C@H](C)CN2CCCC2=O)cn1.
What is the InChIKey of 1-(2-methylphenyl)-N-[(2R)-1-(2-oxopyrrolidin-1-yl)propan-2-yl]pyrazole-4-carboxamide?
The InChIKey is WNEKLQOYKABMAU-CQSZACIVSA-N. The full InChI is InChI=1S/C18H22N4O2/c1-13-6-3-4-7-16(13)22-12-15(10-19-22)18(24)20-14(2)11-21-9-5-8-17(21)23/h3-4,6-7,10,12,14H,5,8-9,11H2,1-2H3,(H,20,24)/t14-/m1/s1.
What are the key properties of 1-(2-methylphenyl)-N-[(2R)-1-(2-oxopyrrolidin-1-yl)propan-2-yl]pyrazole-4-carboxamide?
1-(2-methylphenyl)-N-[(2R)-1-(2-oxopyrrolidin-1-yl)propan-2-yl]pyrazole-4-carboxamide has a molecular weight of 326.40 g/mol, XLogP of 1.92, 5 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(2-methylphenyl)-N-[(2R)-1-(2-oxopyrrolidin-1-yl)propan-2-yl]pyrazole-4-carboxamide is sourced from PubChem (CID 95316080), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).