(5-methoxy-7,8-dimethylimidazo[1,2-a]quinolin-2-yl)-phenylmethanone

C21H18N2O2 — CID 13055790

IUPAC(5-methoxy-7,8-dimethylimidazo[1,2-a]quinolin-2-yl)-phenylmethanone
SMILESCOc1cc2nc(C(=O)c3ccccc3)cn2c2cc(C)c(C)cc12
InChIInChI=1S/C21H18N2O2/c1-13-9-16-18(10-14(13)2)23-12-17(22-20(23)11-19(16)25-3)21(24)15-7-5-4-6-8-15/h4-12H,1-3H3
InChIKeyZEZCWFVWOCIMQE-UHFFFAOYSA-N
MW330.39 g/mol
LogP4.34
Rot. Bonds3

About (5-methoxy-7,8-dimethylimidazo[1,2-a]quinolin-2-yl)-phenylmethanone

(5-methoxy-7,8-dimethylimidazo[1,2-a]quinolin-2-yl)-phenylmethanone (PubChem CID 13055790) has the molecular formula C21H18N2O2 and a molecular weight of 330.39 g/mol. Its IUPAC name is (5-methoxy-7,8-dimethylimidazo[1,2-a]quinolin-2-yl)-phenylmethanone.

Molecular Properties

Compound Name(5-methoxy-7,8-dimethylimidazo[1,2-a]quinolin-2-yl)-phenylmethanone
PubChem CID13055790
Molecular FormulaC21H18N2O2
Molecular Weight330.39 g/mol
Exact Mass330.14
IUPAC Name(5-methoxy-7,8-dimethylimidazo[1,2-a]quinolin-2-yl)-phenylmethanone
SMILESCOc1cc2nc(C(=O)c3ccccc3)cn2c2cc(C)c(C)cc12
InChIInChI=1S/C21H18N2O2/c1-13-9-16-18(10-14(13)2)23-12-17(22-20(23)11-19(16)25-3)21(24)15-7-5-4-6-8-15/h4-12H,1-3H3
InChIKeyZEZCWFVWOCIMQE-UHFFFAOYSA-N
XLogP4.34
TPSA43.60 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms25
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500330.39
LogP ≤ 54.34
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

Analyze (5-methoxy-7,8-dimethylimidazo[1,2-a]quinolin-2-yl)-phenylmethanone with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Frequently Asked Questions

What is the IUPAC name of (5-methoxy-7,8-dimethylimidazo[1,2-a]quinolin-2-yl)-phenylmethanone?
The IUPAC name of (5-methoxy-7,8-dimethylimidazo[1,2-a]quinolin-2-yl)-phenylmethanone (CID 13055790) is (5-methoxy-7,8-dimethylimidazo[1,2-a]quinolin-2-yl)-phenylmethanone.
What is the SMILES notation for (5-methoxy-7,8-dimethylimidazo[1,2-a]quinolin-2-yl)-phenylmethanone?
The canonical SMILES for (5-methoxy-7,8-dimethylimidazo[1,2-a]quinolin-2-yl)-phenylmethanone is COc1cc2nc(C(=O)c3ccccc3)cn2c2cc(C)c(C)cc12.
What is the InChIKey of (5-methoxy-7,8-dimethylimidazo[1,2-a]quinolin-2-yl)-phenylmethanone?
The InChIKey is ZEZCWFVWOCIMQE-UHFFFAOYSA-N. The full InChI is InChI=1S/C21H18N2O2/c1-13-9-16-18(10-14(13)2)23-12-17(22-20(23)11-19(16)25-3)21(24)15-7-5-4-6-8-15/h4-12H,1-3H3.
What are the key properties of (5-methoxy-7,8-dimethylimidazo[1,2-a]quinolin-2-yl)-phenylmethanone?
(5-methoxy-7,8-dimethylimidazo[1,2-a]quinolin-2-yl)-phenylmethanone has a molecular weight of 330.39 g/mol, XLogP of 4.34, 3 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for (5-methoxy-7,8-dimethylimidazo[1,2-a]quinolin-2-yl)-phenylmethanone is sourced from PubChem (CID 13055790), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).