1H-imidazole-2-carboxamide;2H-triazole-4-carboxamide

C7H9N7O2 — CID 135318727

IUPAC1H-imidazole-2-carboxamide;2H-triazole-4-carboxamide
SMILESNC(=O)c1cn[nH]n1.NC(=O)c1ncc[nH]1
InChIInChI=1S/C4H5N3O.C3H4N4O/c5-3(8)4-6-1-2-7-4;4-3(8)2-1-5-7-6-2/h1-2H,(H2,5,8)(H,6,7);1H,(H2,4,8)(H,5,6,7)
InChIKeyJCWLSPQMFRCEDT-UHFFFAOYSA-N
MW223.20 g/mol
LogP-1.59
Rot. Bonds2

About 1H-imidazole-2-carboxamide;2H-triazole-4-carboxamide

1H-imidazole-2-carboxamide;2H-triazole-4-carboxamide (PubChem CID 135318727) has the molecular formula C7H9N7O2 and a molecular weight of 223.20 g/mol. Its IUPAC name is 1H-imidazole-2-carboxamide;2H-triazole-4-carboxamide.

Molecular Properties

Compound Name1H-imidazole-2-carboxamide;2H-triazole-4-carboxamide
PubChem CID135318727
Molecular FormulaC7H9N7O2
Molecular Weight223.20 g/mol
Exact Mass223.08
IUPAC Name1H-imidazole-2-carboxamide;2H-triazole-4-carboxamide
SMILESNC(=O)c1cn[nH]n1.NC(=O)c1ncc[nH]1
InChIInChI=1S/C4H5N3O.C3H4N4O/c5-3(8)4-6-1-2-7-4;4-3(8)2-1-5-7-6-2/h1-2H,(H2,5,8)(H,6,7);1H,(H2,4,8)(H,5,6,7)
InChIKeyJCWLSPQMFRCEDT-UHFFFAOYSA-N
XLogP-1.59
TPSA156.43 Ų
H-Bond Donors4
H-Bond Acceptors5
Rotatable Bonds2
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500223.20
LogP ≤ 5-1.59
H-Bond Donors ≤ 54
H-Bond Acceptors ≤ 105

Analyze 1H-imidazole-2-carboxamide;2H-triazole-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

2,4-dimethyl-1,3,5-triazine;1H-imidazole-2-carboxamide
CID 67924599
1H-imidazole-2-carboxamide;N-methyliminonitrous amide
CID 87878969
2H-triazole-4-carbohydrazide
CID 50989778
1H-imidazole-2-carbothioamide
CID 18521648
2-(1H-imidazole-2-carbonyl)benzamide
CID 607520
gold(3+);tris(2H-triazole-4-carboxylate)
CID 175349287
azane;cobalt;1H-imidazole-2-carboxylic acid
CID 175883152
magnesium bis(2H-triazole-4-carboxylate)
CID 170158138
ethane;ethyl 1H-imidazole-2-carboxylate
CID 143717895
1H-imidazol-2-yl(pyrazin-2-yl)methanone
CID 57100700
2H-triazole-4-carboximidamide;hydrochloride
CID 136981736
2-sulfanylethyl 1H-imidazole-2-carboxylate
CID 168757936

Frequently Asked Questions

What is the IUPAC name of 1H-imidazole-2-carboxamide;2H-triazole-4-carboxamide?
The IUPAC name of 1H-imidazole-2-carboxamide;2H-triazole-4-carboxamide (CID 135318727) is 1H-imidazole-2-carboxamide;2H-triazole-4-carboxamide.
What is the SMILES notation for 1H-imidazole-2-carboxamide;2H-triazole-4-carboxamide?
The canonical SMILES for 1H-imidazole-2-carboxamide;2H-triazole-4-carboxamide is NC(=O)c1cn[nH]n1.NC(=O)c1ncc[nH]1.
What is the InChIKey of 1H-imidazole-2-carboxamide;2H-triazole-4-carboxamide?
The InChIKey is JCWLSPQMFRCEDT-UHFFFAOYSA-N. The full InChI is InChI=1S/C4H5N3O.C3H4N4O/c5-3(8)4-6-1-2-7-4;4-3(8)2-1-5-7-6-2/h1-2H,(H2,5,8)(H,6,7);1H,(H2,4,8)(H,5,6,7).
What are the key properties of 1H-imidazole-2-carboxamide;2H-triazole-4-carboxamide?
1H-imidazole-2-carboxamide;2H-triazole-4-carboxamide has a molecular weight of 223.20 g/mol, XLogP of -1.59, 2 rotatable bonds, 4 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 1H-imidazole-2-carboxamide;2H-triazole-4-carboxamide is sourced from PubChem (CID 135318727), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).