N-[4-(5-methyltriazol-1-yl)phenyl]-5-oxo-1-phenylpyrrolidine-3-carboxamide

C20H19N5O2 — CID 17015586

IUPACN-[4-(5-methyltriazol-1-yl)phenyl]-5-oxo-1-phenylpyrrolidine-3-carboxamide
SMILESCc1cnnn1-c1ccc(NC(=O)C2CC(=O)N(c3ccccc3)C2)cc1
InChIInChI=1S/C20H19N5O2/c1-14-12-21-23-25(14)18-9-7-16(8-10-18)22-20(27)15-11-19(26)24(13-15)17-5-3-2-4-6-17/h2-10,12,15H,11,13H2,1H3,(H,22,27)
InChIKeyGOTUNHRTMGQTLC-UHFFFAOYSA-N
MW361.41 g/mol
LogP2.57
Rot. Bonds4

About N-[4-(5-methyltriazol-1-yl)phenyl]-5-oxo-1-phenylpyrrolidine-3-carboxamide

N-[4-(5-methyltriazol-1-yl)phenyl]-5-oxo-1-phenylpyrrolidine-3-carboxamide (PubChem CID 17015586) has the molecular formula C20H19N5O2 and a molecular weight of 361.41 g/mol. Its IUPAC name is N-[4-(5-methyltriazol-1-yl)phenyl]-5-oxo-1-phenylpyrrolidine-3-carboxamide.

Molecular Properties

Compound NameN-[4-(5-methyltriazol-1-yl)phenyl]-5-oxo-1-phenylpyrrolidine-3-carboxamide
PubChem CID17015586
Molecular FormulaC20H19N5O2
Molecular Weight361.41 g/mol
Exact Mass361.15
IUPAC NameN-[4-(5-methyltriazol-1-yl)phenyl]-5-oxo-1-phenylpyrrolidine-3-carboxamide
SMILESCc1cnnn1-c1ccc(NC(=O)C2CC(=O)N(c3ccccc3)C2)cc1
InChIInChI=1S/C20H19N5O2/c1-14-12-21-23-25(14)18-9-7-16(8-10-18)22-20(27)15-11-19(26)24(13-15)17-5-3-2-4-6-17/h2-10,12,15H,11,13H2,1H3,(H,22,27)
InChIKeyGOTUNHRTMGQTLC-UHFFFAOYSA-N
XLogP2.57
TPSA80.12 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds4
Heavy Atoms27
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500361.41
LogP ≤ 52.57
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

Analyze N-[4-(5-methyltriazol-1-yl)phenyl]-5-oxo-1-phenylpyrrolidine-3-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

2-[4-(2-azidoethyl)triazol-1-yl]-N-[4-[[2-[4-(2-azidoethyl)triazol-1-yl]acetyl]amino]phenyl]acetamide
CID 168271291
2-(4-cyclopropyltriazol-1-yl)-N-[4-[[2-(4-cyclopropyltriazol-1-yl)acetyl]amino]phenyl]acetamide
CID 168272001
2-[4-(3-methylbutyl)triazol-1-yl]-N-[4-[[2-[4-(3-methylbutyl)triazol-1-yl]acetyl]amino]phenyl]acetamide
CID 168276368
1-(4-fluorophenyl)-5-methyl-N-[4-(5-methyl-1H-1,2,3-triazol-1-yl)phenyl]-1H-1,2,3-triazole-4-carboxamide
CID 16649417
1-(2-fluorophenyl)-5-methyl-N-(4-(5-methyl-1H-1,2,3-triazol-1-yl)phenyl)-1H-1,2,3-triazole-4-carboxamide
CID 16649418
N-[p-(5-methyl-1H-1,2,3-triazol-1-yl)phenyl]-(S)-5-oxo-1-phenyl-3-pyrrolidinecarboxamide
CID 42107632
4-[4-(4-Phenylpiperazinilmetil)-1H-1,2,3-triazol-4-yl]acetamide
CID 46228601
2-(diethylamino)-N-[(1-phenyltriazol-4-yl)methyl]acetamide
CID 51050633
4-(dimethylamino)-N-[1-(1-phenyltriazol-4-yl)ethyl]butanamide
CID 71917954
N-[2-[1-(4-fluorophenyl)pyrazol-3-yl]ethyl]-1-methyl-5-oxopyrrolidine-3-carboxamide
CID 71994283
5-methyl-N-(4-(5-methyl-1H-1,2,3-triazol-1-yl)phenyl)-1-phenyl-1H-1,2,3-triazole-4-carboxamide
CID 16649416
(3S,4S)-1-[1-(4-fluorophenyl)triazole-4-carbonyl]-4-methylpyrrolidine-3-carboxamide
CID 128983975

Frequently Asked Questions

What is the IUPAC name of N-[4-(5-methyltriazol-1-yl)phenyl]-5-oxo-1-phenylpyrrolidine-3-carboxamide?
The IUPAC name of N-[4-(5-methyltriazol-1-yl)phenyl]-5-oxo-1-phenylpyrrolidine-3-carboxamide (CID 17015586) is N-[4-(5-methyltriazol-1-yl)phenyl]-5-oxo-1-phenylpyrrolidine-3-carboxamide.
What is the SMILES notation for N-[4-(5-methyltriazol-1-yl)phenyl]-5-oxo-1-phenylpyrrolidine-3-carboxamide?
The canonical SMILES for N-[4-(5-methyltriazol-1-yl)phenyl]-5-oxo-1-phenylpyrrolidine-3-carboxamide is Cc1cnnn1-c1ccc(NC(=O)C2CC(=O)N(c3ccccc3)C2)cc1.
What is the InChIKey of N-[4-(5-methyltriazol-1-yl)phenyl]-5-oxo-1-phenylpyrrolidine-3-carboxamide?
The InChIKey is GOTUNHRTMGQTLC-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H19N5O2/c1-14-12-21-23-25(14)18-9-7-16(8-10-18)22-20(27)15-11-19(26)24(13-15)17-5-3-2-4-6-17/h2-10,12,15H,11,13H2,1H3,(H,22,27).
What are the key properties of N-[4-(5-methyltriazol-1-yl)phenyl]-5-oxo-1-phenylpyrrolidine-3-carboxamide?
N-[4-(5-methyltriazol-1-yl)phenyl]-5-oxo-1-phenylpyrrolidine-3-carboxamide has a molecular weight of 361.41 g/mol, XLogP of 2.57, 4 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N-[4-(5-methyltriazol-1-yl)phenyl]-5-oxo-1-phenylpyrrolidine-3-carboxamide is sourced from PubChem (CID 17015586), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).