N-(2-chlorophenyl)-6-phenylpyrido[1,2-a]benzimidazol-8-amine

C23H16ClN3 — CID 146300968

IUPACN-(2-chlorophenyl)-6-phenylpyrido[1,2-a]benzimidazol-8-amine
SMILESClc1ccccc1Nc1cc(-c2ccccc2)c2nc3ccccn3c2c1
InChIInChI=1S/C23H16ClN3/c24-19-10-4-5-11-20(19)25-17-14-18(16-8-2-1-3-9-16)23-21(15-17)27-13-7-6-12-22(27)26-23/h1-15,25H
InChIKeyQGCHARGDUXSRFV-UHFFFAOYSA-N
MW369.86 g/mol
LogP6.55
Rot. Bonds3

About N-(2-chlorophenyl)-6-phenylpyrido[1,2-a]benzimidazol-8-amine

N-(2-chlorophenyl)-6-phenylpyrido[1,2-a]benzimidazol-8-amine (PubChem CID 146300968) has the molecular formula C23H16ClN3 and a molecular weight of 369.86 g/mol. Its IUPAC name is N-(2-chlorophenyl)-6-phenylpyrido[1,2-a]benzimidazol-8-amine.

Molecular Properties

Compound NameN-(2-chlorophenyl)-6-phenylpyrido[1,2-a]benzimidazol-8-amine
PubChem CID146300968
Molecular FormulaC23H16ClN3
Molecular Weight369.86 g/mol
Exact Mass369.10
IUPAC NameN-(2-chlorophenyl)-6-phenylpyrido[1,2-a]benzimidazol-8-amine
SMILESClc1ccccc1Nc1cc(-c2ccccc2)c2nc3ccccn3c2c1
InChIInChI=1S/C23H16ClN3/c24-19-10-4-5-11-20(19)25-17-14-18(16-8-2-1-3-9-16)23-21(15-17)27-13-7-6-12-22(27)26-23/h1-15,25H
InChIKeyQGCHARGDUXSRFV-UHFFFAOYSA-N
XLogP6.55
TPSA29.33 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms27
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500369.86
LogP ≤ 56.55
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of N-(2-chlorophenyl)-6-phenylpyrido[1,2-a]benzimidazol-8-amine?
The IUPAC name of N-(2-chlorophenyl)-6-phenylpyrido[1,2-a]benzimidazol-8-amine (CID 146300968) is N-(2-chlorophenyl)-6-phenylpyrido[1,2-a]benzimidazol-8-amine.
What is the SMILES notation for N-(2-chlorophenyl)-6-phenylpyrido[1,2-a]benzimidazol-8-amine?
The canonical SMILES for N-(2-chlorophenyl)-6-phenylpyrido[1,2-a]benzimidazol-8-amine is Clc1ccccc1Nc1cc(-c2ccccc2)c2nc3ccccn3c2c1.
What is the InChIKey of N-(2-chlorophenyl)-6-phenylpyrido[1,2-a]benzimidazol-8-amine?
The InChIKey is QGCHARGDUXSRFV-UHFFFAOYSA-N. The full InChI is InChI=1S/C23H16ClN3/c24-19-10-4-5-11-20(19)25-17-14-18(16-8-2-1-3-9-16)23-21(15-17)27-13-7-6-12-22(27)26-23/h1-15,25H.
What are the key properties of N-(2-chlorophenyl)-6-phenylpyrido[1,2-a]benzimidazol-8-amine?
N-(2-chlorophenyl)-6-phenylpyrido[1,2-a]benzimidazol-8-amine has a molecular weight of 369.86 g/mol, XLogP of 6.55, 3 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2-chlorophenyl)-6-phenylpyrido[1,2-a]benzimidazol-8-amine is sourced from PubChem (CID 146300968), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).