2-methyl-1-(2-methylphenyl)-3-phenyl-2H-imidazo[4,5-g]quinoline

C24H21N3 — CID 130318823

IUPAC2-methyl-1-(2-methylphenyl)-3-phenyl-2H-imidazo[4,5-g]quinoline
SMILESCc1ccccc1N1c2cc3cccnc3cc2N(c2ccccc2)C1C
InChIInChI=1S/C24H21N3/c1-17-9-6-7-13-22(17)27-18(2)26(20-11-4-3-5-12-20)24-16-21-19(15-23(24)27)10-8-14-25-21/h3-16,18H,1-2H3
InChIKeyCCQFUCXKDCQEDI-UHFFFAOYSA-N
MW351.45 g/mol
LogP6.18
Rot. Bonds2

About 2-methyl-1-(2-methylphenyl)-3-phenyl-2H-imidazo[4,5-g]quinoline

2-methyl-1-(2-methylphenyl)-3-phenyl-2H-imidazo[4,5-g]quinoline (PubChem CID 130318823) has the molecular formula C24H21N3 and a molecular weight of 351.45 g/mol. Its IUPAC name is 2-methyl-1-(2-methylphenyl)-3-phenyl-2H-imidazo[4,5-g]quinoline.

Molecular Properties

Compound Name2-methyl-1-(2-methylphenyl)-3-phenyl-2H-imidazo[4,5-g]quinoline
PubChem CID130318823
Molecular FormulaC24H21N3
Molecular Weight351.45 g/mol
Exact Mass351.17
IUPAC Name2-methyl-1-(2-methylphenyl)-3-phenyl-2H-imidazo[4,5-g]quinoline
SMILESCc1ccccc1N1c2cc3cccnc3cc2N(c2ccccc2)C1C
InChIInChI=1S/C24H21N3/c1-17-9-6-7-13-22(17)27-18(2)26(20-11-4-3-5-12-20)24-16-21-19(15-23(24)27)10-8-14-25-21/h3-16,18H,1-2H3
InChIKeyCCQFUCXKDCQEDI-UHFFFAOYSA-N
XLogP6.18
TPSA19.37 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms27
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500351.45
LogP ≤ 56.18
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 2-methyl-1-(2-methylphenyl)-3-phenyl-2H-imidazo[4,5-g]quinoline?
The IUPAC name of 2-methyl-1-(2-methylphenyl)-3-phenyl-2H-imidazo[4,5-g]quinoline (CID 130318823) is 2-methyl-1-(2-methylphenyl)-3-phenyl-2H-imidazo[4,5-g]quinoline.
What is the SMILES notation for 2-methyl-1-(2-methylphenyl)-3-phenyl-2H-imidazo[4,5-g]quinoline?
The canonical SMILES for 2-methyl-1-(2-methylphenyl)-3-phenyl-2H-imidazo[4,5-g]quinoline is Cc1ccccc1N1c2cc3cccnc3cc2N(c2ccccc2)C1C.
What is the InChIKey of 2-methyl-1-(2-methylphenyl)-3-phenyl-2H-imidazo[4,5-g]quinoline?
The InChIKey is CCQFUCXKDCQEDI-UHFFFAOYSA-N. The full InChI is InChI=1S/C24H21N3/c1-17-9-6-7-13-22(17)27-18(2)26(20-11-4-3-5-12-20)24-16-21-19(15-23(24)27)10-8-14-25-21/h3-16,18H,1-2H3.
What are the key properties of 2-methyl-1-(2-methylphenyl)-3-phenyl-2H-imidazo[4,5-g]quinoline?
2-methyl-1-(2-methylphenyl)-3-phenyl-2H-imidazo[4,5-g]quinoline has a molecular weight of 351.45 g/mol, XLogP of 6.18, 2 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-methyl-1-(2-methylphenyl)-3-phenyl-2H-imidazo[4,5-g]quinoline is sourced from PubChem (CID 130318823), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).