3-(1-ethyl-5-methylbenzimidazol-2-yl)pyrazin-2-amine

C14H15N5 — CID 63262209

IUPAC3-(1-ethyl-5-methylbenzimidazol-2-yl)pyrazin-2-amine
SMILESCCn1c(-c2nccnc2N)nc2cc(C)ccc21
InChIInChI=1S/C14H15N5/c1-3-19-11-5-4-9(2)8-10(11)18-14(19)12-13(15)17-7-6-16-12/h4-8H,3H2,1-2H3,(H2,15,17)
InChIKeyFAZSXZVUVVNBON-UHFFFAOYSA-N
MW253.31 g/mol
LogP2.40
Rot. Bonds2

About 3-(1-ethyl-5-methylbenzimidazol-2-yl)pyrazin-2-amine

3-(1-ethyl-5-methylbenzimidazol-2-yl)pyrazin-2-amine (PubChem CID 63262209) has the molecular formula C14H15N5 and a molecular weight of 253.31 g/mol. Its IUPAC name is 3-(1-ethyl-5-methylbenzimidazol-2-yl)pyrazin-2-amine.

Molecular Properties

Compound Name3-(1-ethyl-5-methylbenzimidazol-2-yl)pyrazin-2-amine
PubChem CID63262209
Molecular FormulaC14H15N5
Molecular Weight253.31 g/mol
Exact Mass253.13
IUPAC Name3-(1-ethyl-5-methylbenzimidazol-2-yl)pyrazin-2-amine
SMILESCCn1c(-c2nccnc2N)nc2cc(C)ccc21
InChIInChI=1S/C14H15N5/c1-3-19-11-5-4-9(2)8-10(11)18-14(19)12-13(15)17-7-6-16-12/h4-8H,3H2,1-2H3,(H2,15,17)
InChIKeyFAZSXZVUVVNBON-UHFFFAOYSA-N
XLogP2.40
TPSA69.62 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds2
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500253.31
LogP ≤ 52.40
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Frequently Asked Questions

What is the IUPAC name of 3-(1-ethyl-5-methylbenzimidazol-2-yl)pyrazin-2-amine?
The IUPAC name of 3-(1-ethyl-5-methylbenzimidazol-2-yl)pyrazin-2-amine (CID 63262209) is 3-(1-ethyl-5-methylbenzimidazol-2-yl)pyrazin-2-amine.
What is the SMILES notation for 3-(1-ethyl-5-methylbenzimidazol-2-yl)pyrazin-2-amine?
The canonical SMILES for 3-(1-ethyl-5-methylbenzimidazol-2-yl)pyrazin-2-amine is CCn1c(-c2nccnc2N)nc2cc(C)ccc21.
What is the InChIKey of 3-(1-ethyl-5-methylbenzimidazol-2-yl)pyrazin-2-amine?
The InChIKey is FAZSXZVUVVNBON-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H15N5/c1-3-19-11-5-4-9(2)8-10(11)18-14(19)12-13(15)17-7-6-16-12/h4-8H,3H2,1-2H3,(H2,15,17).
What are the key properties of 3-(1-ethyl-5-methylbenzimidazol-2-yl)pyrazin-2-amine?
3-(1-ethyl-5-methylbenzimidazol-2-yl)pyrazin-2-amine has a molecular weight of 253.31 g/mol, XLogP of 2.40, 2 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 3-(1-ethyl-5-methylbenzimidazol-2-yl)pyrazin-2-amine is sourced from PubChem (CID 63262209), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).