1-ethyl-2-(1-methylbenzimidazol-2-yl)pyrrolo[3,2-c]pyridine

C17H16N4 — CID 141448929

IUPAC1-ethyl-2-(1-methylbenzimidazol-2-yl)pyrrolo[3,2-c]pyridine
SMILESCCn1c(-c2nc3ccccc3n2C)cc2cnccc21
InChIInChI=1S/C17H16N4/c1-3-21-14-8-9-18-11-12(14)10-16(21)17-19-13-6-4-5-7-15(13)20(17)2/h4-11H,3H2,1-2H3
InChIKeyQXLSPJMVGKFKPX-UHFFFAOYSA-N
MW276.34 g/mol
LogP3.61
Rot. Bonds2

About 1-ethyl-2-(1-methylbenzimidazol-2-yl)pyrrolo[3,2-c]pyridine

1-ethyl-2-(1-methylbenzimidazol-2-yl)pyrrolo[3,2-c]pyridine (PubChem CID 141448929) has the molecular formula C17H16N4 and a molecular weight of 276.34 g/mol. Its IUPAC name is 1-ethyl-2-(1-methylbenzimidazol-2-yl)pyrrolo[3,2-c]pyridine.

Molecular Properties

Compound Name1-ethyl-2-(1-methylbenzimidazol-2-yl)pyrrolo[3,2-c]pyridine
PubChem CID141448929
Molecular FormulaC17H16N4
Molecular Weight276.34 g/mol
Exact Mass276.14
IUPAC Name1-ethyl-2-(1-methylbenzimidazol-2-yl)pyrrolo[3,2-c]pyridine
SMILESCCn1c(-c2nc3ccccc3n2C)cc2cnccc21
InChIInChI=1S/C17H16N4/c1-3-21-14-8-9-18-11-12(14)10-16(21)17-19-13-6-4-5-7-15(13)20(17)2/h4-11H,3H2,1-2H3
InChIKeyQXLSPJMVGKFKPX-UHFFFAOYSA-N
XLogP3.61
TPSA35.64 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds2
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500276.34
LogP ≤ 53.61
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of 1-ethyl-2-(1-methylbenzimidazol-2-yl)pyrrolo[3,2-c]pyridine?
The IUPAC name of 1-ethyl-2-(1-methylbenzimidazol-2-yl)pyrrolo[3,2-c]pyridine (CID 141448929) is 1-ethyl-2-(1-methylbenzimidazol-2-yl)pyrrolo[3,2-c]pyridine.
What is the SMILES notation for 1-ethyl-2-(1-methylbenzimidazol-2-yl)pyrrolo[3,2-c]pyridine?
The canonical SMILES for 1-ethyl-2-(1-methylbenzimidazol-2-yl)pyrrolo[3,2-c]pyridine is CCn1c(-c2nc3ccccc3n2C)cc2cnccc21.
What is the InChIKey of 1-ethyl-2-(1-methylbenzimidazol-2-yl)pyrrolo[3,2-c]pyridine?
The InChIKey is QXLSPJMVGKFKPX-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H16N4/c1-3-21-14-8-9-18-11-12(14)10-16(21)17-19-13-6-4-5-7-15(13)20(17)2/h4-11H,3H2,1-2H3.
What are the key properties of 1-ethyl-2-(1-methylbenzimidazol-2-yl)pyrrolo[3,2-c]pyridine?
1-ethyl-2-(1-methylbenzimidazol-2-yl)pyrrolo[3,2-c]pyridine has a molecular weight of 276.34 g/mol, XLogP of 3.61, 2 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 1-ethyl-2-(1-methylbenzimidazol-2-yl)pyrrolo[3,2-c]pyridine is sourced from PubChem (CID 141448929), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).