Skip to content

Azanidazole

C10H10N6O2 — CID 6436171

💊View drug profile → azanidazole

Data last refreshed: (MolForge compound catalog, from PubChem)

IUPAC4-[(E)-2-(1-methyl-5-nitroimidazol-2-yl)ethenyl]pyrimidin-2-amine
SMILESCn1c([N+](=O)[O-])cnc1/C=C/c1ccnc(N)n1
InChIInChI=1S/C10H10N6O2/c1-15-8(13-6-9(15)16(17)18)3-2-7-4-5-12-10(11)14-7/h2-6H,1H3,(H2,11,12,14)/b3-2+
InChIKeyLHIALLMPKJMSIQ-NSCUHMNNSA-N
MW246.23 g/mol
LogP0.87
Rot. Bonds3

About Azanidazole

Azanidazole (PubChem CID 6436171) has the molecular formula C10H10N6O2 and a molecular weight of 246.23 g/mol. Its IUPAC name is 4-[(E)-2-(1-methyl-5-nitroimidazol-2-yl)ethenyl]pyrimidin-2-amine.

Molecular Properties

Compound NameAzanidazole
PubChem CID6436171
Molecular FormulaC10H10N6O2
Molecular Weight246.23 g/mol
Exact Mass246.09
IUPAC Name4-[(E)-2-(1-methyl-5-nitroimidazol-2-yl)ethenyl]pyrimidin-2-amine
SMILESCn1c([N+](=O)[O-])cnc1/C=C/c1ccnc(N)n1
InChIInChI=1S/C10H10N6O2/c1-15-8(13-6-9(15)16(17)18)3-2-7-4-5-12-10(11)14-7/h2-6H,1H3,(H2,11,12,14)/b3-2+
InChIKeyLHIALLMPKJMSIQ-NSCUHMNNSA-N
XLogP0.87
TPSA112.76 Ų
H-Bond Donors1
H-Bond Acceptors7
Rotatable Bonds3
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500246.23
LogP ≤ 50.87
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 107

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'nitro_group', 'substructure': 'N/A'}, {'alert_name': 'Oxygen-nitrogen_single_bond', 'substructure': 'N/A'}

Analyze Azanidazole 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

4-methyl-6-(2-methylimidazol-1-yl)-5-nitro-N-(2-pyridylmethyl)pyrimidin-2-amine
CID 16728894
N-ethyl-4-methyl-6-(2-methylimidazol-1-yl)-5-nitro-pyrimidin-2-amine
CID 16728896
4-methyl-6-(2-methylimidazol-1-yl)-5-nitro-N-sec-butyl-pyrimidin-2-amine
CID 16728897
4-Methyl-6-(2-methylimidazol-1-yl)-5-nitro-pyrimidin-2-amine
CID 16728895
6-methyl-4-N-[3-(2-nitroimidazol-1-yl)propyl]pyrimidine-2,4-diamine;hydrochloride
CID 56851069
N-(3-imidazol-1-ylpropyl)-3-nitropyridin-2-amine
CID 2804811
N-[2-(1-methylimidazol-4-yl)ethyl]-5-nitropyridin-2-amine
CID 10354594
6-methyl-4-N-[4-(2-nitroimidazol-1-yl)butyl]pyrimidine-2,4-diamine;hydrochloride
CID 56851071
Cambridge id 5488678
CID 2849063

Frequently Asked Questions

What is the IUPAC name of Azanidazole?
The IUPAC name of Azanidazole (CID 6436171) is 4-[(E)-2-(1-methyl-5-nitroimidazol-2-yl)ethenyl]pyrimidin-2-amine.
What is the SMILES notation for Azanidazole?
The canonical SMILES for Azanidazole is Cn1c([N+](=O)[O-])cnc1/C=C/c1ccnc(N)n1.
What is the InChIKey of Azanidazole?
The InChIKey is LHIALLMPKJMSIQ-NSCUHMNNSA-N. The full InChI is InChI=1S/C10H10N6O2/c1-15-8(13-6-9(15)16(17)18)3-2-7-4-5-12-10(11)14-7/h2-6H,1H3,(H2,11,12,14)/b3-2+.
What are the key properties of Azanidazole?
Azanidazole has a molecular weight of 246.23 g/mol, XLogP of 0.87, 3 rotatable bonds, 1 hydrogen bond donors, and 7 hydrogen bond acceptors.
Where does this data come from?
All data for Azanidazole is sourced from PubChem (CID 6436171), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).

Browse: Molecules: A · all molecules A–Z · drugs A–Z · protein targets A–Z.

Sources

How this page is built: methodology · editorial policy & corrections.

For research and educational use only — not medical advice. This page is compiled automatically from public databases. It is not written or reviewed by a clinician. Do not start, stop or change any treatment based on it; consult a qualified healthcare professional. Spotted an error? See our corrections policy or email hello@molforge.ai.