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

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Related Compounds

6-(5,6-dimethylbenzimidazol-1-yl)pyrazine-2-carboxylic acid
CID 66455454
4-(5,6-dimethylbenzimidazol-1-yl)-6-methylpyrimidin-2-amine
CID 112726059
4-(5,6-dimethylbenzimidazol-1-yl)-6-hydrazinylpyrimidin-2-amine
CID 80901487
2-(5,6-dimethylbenzimidazol-1-yl)quinoline
CID 17411926
[6-(5,6-dimethylbenzimidazol-1-yl)-2-methylpyrimidin-4-yl]hydrazine
CID 80900481
1-[3,5-bis(5,6-dimethylbenzimidazol-1-yl)-2,4,6-trimethylphenyl]-5,6-dimethylbenzimidazole
CID 122202423
[4-(5,6-dimethylbenzimidazol-1-yl)-5-methylpyrimidin-2-yl]hydrazine
CID 80902137
6-(5,6-dimethylbenzimidazol-1-yl)-N-methylpyrimidin-4-amine
CID 80853780
5-(5,6-dimethylbenzimidazol-1-yl)-1,3-dimethylpyrazol-4-amine
CID 43554356
[4-(5,6-dimethylbenzimidazol-1-yl)-5-fluoropyrimidin-2-yl]hydrazine
CID 80900657
1-(5-fluoropyrimidin-2-yl)-5,6-dimethylbenzimidazole
CID 134862242
3-(6-chloropyrazin-2-yl)benzimidazol-5-amine
CID 58217094

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).