3-methyl-1-(5-methyl-1H-1,2,4-triazole-3-carbonyl)pyrrolidine-3-carboxamide

C10H15N5O2 — CID 114082419

IUPAC3-methyl-1-(5-methyl-1H-1,2,4-triazole-3-carbonyl)pyrrolidine-3-carboxamide
SMILESCc1nc(C(=O)N2CCC(C)(C(N)=O)C2)n[nH]1
InChIInChI=1S/C10H15N5O2/c1-6-12-7(14-13-6)8(16)15-4-3-10(2,5-15)9(11)17/h3-5H2,1-2H3,(H2,11,17)(H,12,13,14)
InChIKeyOBQXPQIUIJKFQO-UHFFFAOYSA-N
MW237.26 g/mol
LogP-0.55
Rot. Bonds2

About 3-methyl-1-(5-methyl-1H-1,2,4-triazole-3-carbonyl)pyrrolidine-3-carboxamide

3-methyl-1-(5-methyl-1H-1,2,4-triazole-3-carbonyl)pyrrolidine-3-carboxamide (PubChem CID 114082419) has the molecular formula C10H15N5O2 and a molecular weight of 237.26 g/mol. Its IUPAC name is 3-methyl-1-(5-methyl-1H-1,2,4-triazole-3-carbonyl)pyrrolidine-3-carboxamide.

Molecular Properties

Compound Name3-methyl-1-(5-methyl-1H-1,2,4-triazole-3-carbonyl)pyrrolidine-3-carboxamide
PubChem CID114082419
Molecular FormulaC10H15N5O2
Molecular Weight237.26 g/mol
Exact Mass237.12
IUPAC Name3-methyl-1-(5-methyl-1H-1,2,4-triazole-3-carbonyl)pyrrolidine-3-carboxamide
SMILESCc1nc(C(=O)N2CCC(C)(C(N)=O)C2)n[nH]1
InChIInChI=1S/C10H15N5O2/c1-6-12-7(14-13-6)8(16)15-4-3-10(2,5-15)9(11)17/h3-5H2,1-2H3,(H2,11,17)(H,12,13,14)
InChIKeyOBQXPQIUIJKFQO-UHFFFAOYSA-N
XLogP-0.55
TPSA104.97 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds2
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500237.26
LogP ≤ 5-0.55
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

Analyze 3-methyl-1-(5-methyl-1H-1,2,4-triazole-3-carbonyl)pyrrolidine-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

(3,3-dimethylazetidin-1-yl)-(5-methyl-1H-1,2,4-triazol-3-yl)methanone
CID 130825736
(3,3-difluoropiperidin-1-yl)-(5-methyl-1H-1,2,4-triazol-3-yl)methanone
CID 145336249
1-(5-ethyl-1H-1,2,4-triazole-3-carbonyl)-N,3-dimethylpyrrolidine-3-carboxamide
CID 106321230
3-methyl-1-(6-oxo-1H-pyridine-2-carbonyl)pyrrolidine-3-carboxamide
CID 114082421
1-[3-(4-chlorophenyl)-1H-pyrazole-5-carbonyl]-3-methylpyrrolidine-3-carboxamide
CID 119037107
2-(3,5-dimethyl-1H-pyrazol-4-yl)-1-[9-(5-methyl-1H-1,2,4-triazole-3-carbonyl)-2,9-diazaspiro[4.5]decan-2-yl]propan-1-one
CID 167933331
(5-methyl-1H-1,2,4-triazol-3-yl)-(1,3-oxazinan-3-yl)methanone
CID 130522636
4-[(3aR,6aS)-2-(5-methyl-1H-1,2,4-triazole-3-carbonyl)-1,3,3a,4,6,6a-hexahydropyrrolo[3,4-c]pyrrole-5-carbonyl]-4-methylpyrrolidin-2-one
CID 167830350
1-(2-bromopyridine-4-carbonyl)-3-methylpyrrolidine-3-carboxamide
CID 114081850
(3-hydroxy-3-methylpyrrolidin-1-yl)-(5-propyl-1H-1,2,4-triazol-3-yl)methanone
CID 103357589
1-(2-iodobenzoyl)-3-methylpyrrolidine-3-carboxamide
CID 114082011
1-(5-cyano-1H-pyrrole-2-carbonyl)-3-methylpyrrolidine-3-carboxamide
CID 136539136

Frequently Asked Questions

What is the IUPAC name of 3-methyl-1-(5-methyl-1H-1,2,4-triazole-3-carbonyl)pyrrolidine-3-carboxamide?
The IUPAC name of 3-methyl-1-(5-methyl-1H-1,2,4-triazole-3-carbonyl)pyrrolidine-3-carboxamide (CID 114082419) is 3-methyl-1-(5-methyl-1H-1,2,4-triazole-3-carbonyl)pyrrolidine-3-carboxamide.
What is the SMILES notation for 3-methyl-1-(5-methyl-1H-1,2,4-triazole-3-carbonyl)pyrrolidine-3-carboxamide?
The canonical SMILES for 3-methyl-1-(5-methyl-1H-1,2,4-triazole-3-carbonyl)pyrrolidine-3-carboxamide is Cc1nc(C(=O)N2CCC(C)(C(N)=O)C2)n[nH]1.
What is the InChIKey of 3-methyl-1-(5-methyl-1H-1,2,4-triazole-3-carbonyl)pyrrolidine-3-carboxamide?
The InChIKey is OBQXPQIUIJKFQO-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H15N5O2/c1-6-12-7(14-13-6)8(16)15-4-3-10(2,5-15)9(11)17/h3-5H2,1-2H3,(H2,11,17)(H,12,13,14).
What are the key properties of 3-methyl-1-(5-methyl-1H-1,2,4-triazole-3-carbonyl)pyrrolidine-3-carboxamide?
3-methyl-1-(5-methyl-1H-1,2,4-triazole-3-carbonyl)pyrrolidine-3-carboxamide has a molecular weight of 237.26 g/mol, XLogP of -0.55, 2 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 3-methyl-1-(5-methyl-1H-1,2,4-triazole-3-carbonyl)pyrrolidine-3-carboxamide is sourced from PubChem (CID 114082419), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).