4-(15N)azanyl-1H-imidazole-5-(14N)carboxamide

C4H6N4O — CID 101129871

IUPAC4-(15N)azanyl-1H-imidazole-5-(14N)carboxamide
SMILES[14NH2]C(=O)c1[nH]cnc1[15NH2]
InChIInChI=1S/C4H6N4O/c5-3-2(4(6)9)7-1-8-3/h1H,5H2,(H2,6,9)(H,7,8)/i5+1,6+0
InChIKeyDVNYTAVYBRSTGK-YJLNIGGRSA-N
MW127.11 g/mol
LogP-0.91
Rot. Bonds1

About 4-(15N)azanyl-1H-imidazole-5-(14N)carboxamide

4-(15N)azanyl-1H-imidazole-5-(14N)carboxamide (PubChem CID 101129871) has the molecular formula C4H6N4O and a molecular weight of 127.11 g/mol. Its IUPAC name is 4-(15N)azanyl-1H-imidazole-5-(14N)carboxamide.

Molecular Properties

Compound Name4-(15N)azanyl-1H-imidazole-5-(14N)carboxamide
PubChem CID101129871
Molecular FormulaC4H6N4O
Molecular Weight127.11 g/mol
Exact Mass127.05
IUPAC Name4-(15N)azanyl-1H-imidazole-5-(14N)carboxamide
SMILES[14NH2]C(=O)c1[nH]cnc1[15NH2]
InChIInChI=1S/C4H6N4O/c5-3-2(4(6)9)7-1-8-3/h1H,5H2,(H2,6,9)(H,7,8)/i5+1,6+0
InChIKeyDVNYTAVYBRSTGK-YJLNIGGRSA-N
XLogP-0.91
TPSA97.79 Ų
H-Bond Donors3
H-Bond Acceptors3
Rotatable Bonds1
Heavy Atoms9
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500127.11
LogP ≤ 5-0.91
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 103

Analyze 4-(15N)azanyl-1H-imidazole-5-(14N)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-(15N)azanyl-1H-imidazole-5-(14N)carboxamide?
The IUPAC name of 4-(15N)azanyl-1H-imidazole-5-(14N)carboxamide (CID 101129871) is 4-(15N)azanyl-1H-imidazole-5-(14N)carboxamide.
What is the SMILES notation for 4-(15N)azanyl-1H-imidazole-5-(14N)carboxamide?
The canonical SMILES for 4-(15N)azanyl-1H-imidazole-5-(14N)carboxamide is [14NH2]C(=O)c1[nH]cnc1[15NH2].
What is the InChIKey of 4-(15N)azanyl-1H-imidazole-5-(14N)carboxamide?
The InChIKey is DVNYTAVYBRSTGK-YJLNIGGRSA-N. The full InChI is InChI=1S/C4H6N4O/c5-3-2(4(6)9)7-1-8-3/h1H,5H2,(H2,6,9)(H,7,8)/i5+1,6+0.
What are the key properties of 4-(15N)azanyl-1H-imidazole-5-(14N)carboxamide?
4-(15N)azanyl-1H-imidazole-5-(14N)carboxamide has a molecular weight of 127.11 g/mol, XLogP of -0.91, 1 rotatable bonds, 3 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 4-(15N)azanyl-1H-imidazole-5-(14N)carboxamide is sourced from PubChem (CID 101129871), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).