1-amino-3-(1,2,4-triazol-1-yl)cyclopentane-1-carboxamide

C8H13N5O — CID 79650821

IUPAC1-amino-3-(1,2,4-triazol-1-yl)cyclopentane-1-carboxamide
SMILESNC(=O)C1(N)CCC(n2cncn2)C1
InChIInChI=1S/C8H13N5O/c9-7(14)8(10)2-1-6(3-8)13-5-11-4-12-13/h4-6H,1-3,10H2,(H2,9,14)
InChIKeyZWWFZGOADAPHHJ-UHFFFAOYSA-N
MW195.23 g/mol
LogP-0.81
Rot. Bonds2

About 1-amino-3-(1,2,4-triazol-1-yl)cyclopentane-1-carboxamide

1-amino-3-(1,2,4-triazol-1-yl)cyclopentane-1-carboxamide (PubChem CID 79650821) has the molecular formula C8H13N5O and a molecular weight of 195.23 g/mol. Its IUPAC name is 1-amino-3-(1,2,4-triazol-1-yl)cyclopentane-1-carboxamide.

Molecular Properties

Compound Name1-amino-3-(1,2,4-triazol-1-yl)cyclopentane-1-carboxamide
PubChem CID79650821
Molecular FormulaC8H13N5O
Molecular Weight195.23 g/mol
Exact Mass195.11
IUPAC Name1-amino-3-(1,2,4-triazol-1-yl)cyclopentane-1-carboxamide
SMILESNC(=O)C1(N)CCC(n2cncn2)C1
InChIInChI=1S/C8H13N5O/c9-7(14)8(10)2-1-6(3-8)13-5-11-4-12-13/h4-6H,1-3,10H2,(H2,9,14)
InChIKeyZWWFZGOADAPHHJ-UHFFFAOYSA-N
XLogP-0.81
TPSA99.82 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds2
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500195.23
LogP ≤ 5-0.81
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

Analyze 1-amino-3-(1,2,4-triazol-1-yl)cyclopentane-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 1-amino-3-(1,2,4-triazol-1-yl)cyclopentane-1-carboxamide?
The IUPAC name of 1-amino-3-(1,2,4-triazol-1-yl)cyclopentane-1-carboxamide (CID 79650821) is 1-amino-3-(1,2,4-triazol-1-yl)cyclopentane-1-carboxamide.
What is the SMILES notation for 1-amino-3-(1,2,4-triazol-1-yl)cyclopentane-1-carboxamide?
The canonical SMILES for 1-amino-3-(1,2,4-triazol-1-yl)cyclopentane-1-carboxamide is NC(=O)C1(N)CCC(n2cncn2)C1.
What is the InChIKey of 1-amino-3-(1,2,4-triazol-1-yl)cyclopentane-1-carboxamide?
The InChIKey is ZWWFZGOADAPHHJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H13N5O/c9-7(14)8(10)2-1-6(3-8)13-5-11-4-12-13/h4-6H,1-3,10H2,(H2,9,14).
What are the key properties of 1-amino-3-(1,2,4-triazol-1-yl)cyclopentane-1-carboxamide?
1-amino-3-(1,2,4-triazol-1-yl)cyclopentane-1-carboxamide has a molecular weight of 195.23 g/mol, XLogP of -0.81, 2 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 1-amino-3-(1,2,4-triazol-1-yl)cyclopentane-1-carboxamide is sourced from PubChem (CID 79650821), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).