4-amino-N-cyclopentyl-3-methyl-5-oxo-1,2,4-triazole-1-carboxamide

C9H15N5O2 — CID 14405218

IUPAC4-amino-N-cyclopentyl-3-methyl-5-oxo-1,2,4-triazole-1-carboxamide
SMILESCc1nn(C(=O)NC2CCCC2)c(=O)n1N
InChIInChI=1S/C9H15N5O2/c1-6-12-14(9(16)13(6)10)8(15)11-7-4-2-3-5-7/h7H,2-5,10H2,1H3,(H,11,15)
InChIKeyPVXCIMMPCBVRPQ-UHFFFAOYSA-N
MW225.25 g/mol
LogP-0.43
Rot. Bonds1

About 4-amino-N-cyclopentyl-3-methyl-5-oxo-1,2,4-triazole-1-carboxamide

4-amino-N-cyclopentyl-3-methyl-5-oxo-1,2,4-triazole-1-carboxamide (PubChem CID 14405218) has the molecular formula C9H15N5O2 and a molecular weight of 225.25 g/mol. Its IUPAC name is 4-amino-N-cyclopentyl-3-methyl-5-oxo-1,2,4-triazole-1-carboxamide.

Molecular Properties

Compound Name4-amino-N-cyclopentyl-3-methyl-5-oxo-1,2,4-triazole-1-carboxamide
PubChem CID14405218
Molecular FormulaC9H15N5O2
Molecular Weight225.25 g/mol
Exact Mass225.12
IUPAC Name4-amino-N-cyclopentyl-3-methyl-5-oxo-1,2,4-triazole-1-carboxamide
SMILESCc1nn(C(=O)NC2CCCC2)c(=O)n1N
InChIInChI=1S/C9H15N5O2/c1-6-12-14(9(16)13(6)10)8(15)11-7-4-2-3-5-7/h7H,2-5,10H2,1H3,(H,11,15)
InChIKeyPVXCIMMPCBVRPQ-UHFFFAOYSA-N
XLogP-0.43
TPSA94.94 Ų
H-Bond Donors2
H-Bond Acceptors6
Rotatable Bonds1
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500225.25
LogP ≤ 5-0.43
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 106

Analyze 4-amino-N-cyclopentyl-3-methyl-5-oxo-1,2,4-triazole-1-carboxamide with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Frequently Asked Questions

What is the IUPAC name of 4-amino-N-cyclopentyl-3-methyl-5-oxo-1,2,4-triazole-1-carboxamide?
The IUPAC name of 4-amino-N-cyclopentyl-3-methyl-5-oxo-1,2,4-triazole-1-carboxamide (CID 14405218) is 4-amino-N-cyclopentyl-3-methyl-5-oxo-1,2,4-triazole-1-carboxamide.
What is the SMILES notation for 4-amino-N-cyclopentyl-3-methyl-5-oxo-1,2,4-triazole-1-carboxamide?
The canonical SMILES for 4-amino-N-cyclopentyl-3-methyl-5-oxo-1,2,4-triazole-1-carboxamide is Cc1nn(C(=O)NC2CCCC2)c(=O)n1N.
What is the InChIKey of 4-amino-N-cyclopentyl-3-methyl-5-oxo-1,2,4-triazole-1-carboxamide?
The InChIKey is PVXCIMMPCBVRPQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H15N5O2/c1-6-12-14(9(16)13(6)10)8(15)11-7-4-2-3-5-7/h7H,2-5,10H2,1H3,(H,11,15).
What are the key properties of 4-amino-N-cyclopentyl-3-methyl-5-oxo-1,2,4-triazole-1-carboxamide?
4-amino-N-cyclopentyl-3-methyl-5-oxo-1,2,4-triazole-1-carboxamide has a molecular weight of 225.25 g/mol, XLogP of -0.43, 1 rotatable bonds, 2 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 4-amino-N-cyclopentyl-3-methyl-5-oxo-1,2,4-triazole-1-carboxamide is sourced from PubChem (CID 14405218), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).