6-(5,6-dimethylbenzimidazol-1-yl)pyrazin-2-amine

C13H13N5 — CID 80647713

IUPAC6-(5,6-dimethylbenzimidazol-1-yl)pyrazin-2-amine
SMILESCc1cc2ncn(-c3cncc(N)n3)c2cc1C
InChIInChI=1S/C13H13N5/c1-8-3-10-11(4-9(8)2)18(7-16-10)13-6-15-5-12(14)17-13/h3-7H,1-2H3,(H2,14,17)
InChIKeyWCERRBKLPOEMBB-UHFFFAOYSA-N
MW239.28 g/mol
LogP2.01
Rot. Bonds1

About 6-(5,6-dimethylbenzimidazol-1-yl)pyrazin-2-amine

6-(5,6-dimethylbenzimidazol-1-yl)pyrazin-2-amine (PubChem CID 80647713) has the molecular formula C13H13N5 and a molecular weight of 239.28 g/mol. Its IUPAC name is 6-(5,6-dimethylbenzimidazol-1-yl)pyrazin-2-amine.

Molecular Properties

Compound Name6-(5,6-dimethylbenzimidazol-1-yl)pyrazin-2-amine
PubChem CID80647713
Molecular FormulaC13H13N5
Molecular Weight239.28 g/mol
Exact Mass239.12
IUPAC Name6-(5,6-dimethylbenzimidazol-1-yl)pyrazin-2-amine
SMILESCc1cc2ncn(-c3cncc(N)n3)c2cc1C
InChIInChI=1S/C13H13N5/c1-8-3-10-11(4-9(8)2)18(7-16-10)13-6-15-5-12(14)17-13/h3-7H,1-2H3,(H2,14,17)
InChIKeyWCERRBKLPOEMBB-UHFFFAOYSA-N
XLogP2.01
TPSA69.62 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds1
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500239.28
LogP ≤ 52.01
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

Analyze 6-(5,6-dimethylbenzimidazol-1-yl)pyrazin-2-amine 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

CID 57469
CID 57469
CID 46220502
CID 46220502
CID 1530
CID 1530
CID 49971
CID 49971
CID 53462
CID 53462
CID 62274
CID 62274
CID 675
CID 675
CID 11256587
CID 11256587
CID 104739
CID 104739
CID 16659285
CID 16659285
CID 53262401
CID 53262401
CID 247635
CID 247635

Frequently Asked Questions

What is the IUPAC name of 6-(5,6-dimethylbenzimidazol-1-yl)pyrazin-2-amine?
The IUPAC name of 6-(5,6-dimethylbenzimidazol-1-yl)pyrazin-2-amine (CID 80647713) is 6-(5,6-dimethylbenzimidazol-1-yl)pyrazin-2-amine.
What is the SMILES notation for 6-(5,6-dimethylbenzimidazol-1-yl)pyrazin-2-amine?
The canonical SMILES for 6-(5,6-dimethylbenzimidazol-1-yl)pyrazin-2-amine is Cc1cc2ncn(-c3cncc(N)n3)c2cc1C.
What is the InChIKey of 6-(5,6-dimethylbenzimidazol-1-yl)pyrazin-2-amine?
The InChIKey is WCERRBKLPOEMBB-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H13N5/c1-8-3-10-11(4-9(8)2)18(7-16-10)13-6-15-5-12(14)17-13/h3-7H,1-2H3,(H2,14,17).
What are the key properties of 6-(5,6-dimethylbenzimidazol-1-yl)pyrazin-2-amine?
6-(5,6-dimethylbenzimidazol-1-yl)pyrazin-2-amine has a molecular weight of 239.28 g/mol, XLogP of 2.01, 1 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 6-(5,6-dimethylbenzimidazol-1-yl)pyrazin-2-amine is sourced from PubChem (CID 80647713), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).