3,4-dihydro-2H-pyrido[1,2-a]benzimidazol-1-one

C11H10N2O — CID 14171670

IUPAC3,4-dihydro-2H-pyrido[1,2-a]benzimidazol-1-one
SMILESO=C1CCCc2nc3ccccc3n21
InChIInChI=1S/C11H10N2O/c14-11-7-3-6-10-12-8-4-1-2-5-9(8)13(10)11/h1-2,4-5H,3,6-7H2
InChIKeyYEPJEXAFQVBQJN-UHFFFAOYSA-N
MW186.21 g/mol
LogP2.01
Rot. Bonds

About 3,4-dihydro-2H-pyrido[1,2-a]benzimidazol-1-one

3,4-dihydro-2H-pyrido[1,2-a]benzimidazol-1-one (PubChem CID 14171670) has the molecular formula C11H10N2O and a molecular weight of 186.21 g/mol. Its IUPAC name is 3,4-dihydro-2H-pyrido[1,2-a]benzimidazol-1-one.

Molecular Properties

Compound Name3,4-dihydro-2H-pyrido[1,2-a]benzimidazol-1-one
PubChem CID14171670
Molecular FormulaC11H10N2O
Molecular Weight186.21 g/mol
Exact Mass186.08
IUPAC Name3,4-dihydro-2H-pyrido[1,2-a]benzimidazol-1-one
SMILESO=C1CCCc2nc3ccccc3n21
InChIInChI=1S/C11H10N2O/c14-11-7-3-6-10-12-8-4-1-2-5-9(8)13(10)11/h1-2,4-5H,3,6-7H2
InChIKeyYEPJEXAFQVBQJN-UHFFFAOYSA-N
XLogP2.01
TPSA34.89 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500186.21
LogP ≤ 52.01
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 3,4-dihydro-2H-pyrido[1,2-a]benzimidazol-1-one?
The IUPAC name of 3,4-dihydro-2H-pyrido[1,2-a]benzimidazol-1-one (CID 14171670) is 3,4-dihydro-2H-pyrido[1,2-a]benzimidazol-1-one.
What is the SMILES notation for 3,4-dihydro-2H-pyrido[1,2-a]benzimidazol-1-one?
The canonical SMILES for 3,4-dihydro-2H-pyrido[1,2-a]benzimidazol-1-one is O=C1CCCc2nc3ccccc3n21.
What is the InChIKey of 3,4-dihydro-2H-pyrido[1,2-a]benzimidazol-1-one?
The InChIKey is YEPJEXAFQVBQJN-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H10N2O/c14-11-7-3-6-10-12-8-4-1-2-5-9(8)13(10)11/h1-2,4-5H,3,6-7H2.
What are the key properties of 3,4-dihydro-2H-pyrido[1,2-a]benzimidazol-1-one?
3,4-dihydro-2H-pyrido[1,2-a]benzimidazol-1-one has a molecular weight of 186.21 g/mol, XLogP of 2.01, 0 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 3,4-dihydro-2H-pyrido[1,2-a]benzimidazol-1-one is sourced from PubChem (CID 14171670), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).