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

C20H16N2O2 — CID 13055764

IUPAC(5-methoxy-7-methylimidazo[1,2-a]quinolin-2-yl)-phenylmethanone
SMILESCOc1cc2nc(C(=O)c3ccccc3)cn2c2ccc(C)cc12
InChIInChI=1S/C20H16N2O2/c1-13-8-9-17-15(10-13)18(24-2)11-19-21-16(12-22(17)19)20(23)14-6-4-3-5-7-14/h3-12H,1-2H3
InChIKeyVWMRGUFQLUIYBP-UHFFFAOYSA-N
MW316.36 g/mol
LogP4.04
Rot. Bonds3

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

(5-methoxy-7-methylimidazo[1,2-a]quinolin-2-yl)-phenylmethanone (PubChem CID 13055764) has the molecular formula C20H16N2O2 and a molecular weight of 316.36 g/mol. Its IUPAC name is (5-methoxy-7-methylimidazo[1,2-a]quinolin-2-yl)-phenylmethanone.

Molecular Properties

Compound Name(5-methoxy-7-methylimidazo[1,2-a]quinolin-2-yl)-phenylmethanone
PubChem CID13055764
Molecular FormulaC20H16N2O2
Molecular Weight316.36 g/mol
Exact Mass316.12
IUPAC Name(5-methoxy-7-methylimidazo[1,2-a]quinolin-2-yl)-phenylmethanone
SMILESCOc1cc2nc(C(=O)c3ccccc3)cn2c2ccc(C)cc12
InChIInChI=1S/C20H16N2O2/c1-13-8-9-17-15(10-13)18(24-2)11-19-21-16(12-22(17)19)20(23)14-6-4-3-5-7-14/h3-12H,1-2H3
InChIKeyVWMRGUFQLUIYBP-UHFFFAOYSA-N
XLogP4.04
TPSA43.60 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500316.36
LogP ≤ 54.04
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of (5-methoxy-7-methylimidazo[1,2-a]quinolin-2-yl)-phenylmethanone?
The IUPAC name of (5-methoxy-7-methylimidazo[1,2-a]quinolin-2-yl)-phenylmethanone (CID 13055764) is (5-methoxy-7-methylimidazo[1,2-a]quinolin-2-yl)-phenylmethanone.
What is the SMILES notation for (5-methoxy-7-methylimidazo[1,2-a]quinolin-2-yl)-phenylmethanone?
The canonical SMILES for (5-methoxy-7-methylimidazo[1,2-a]quinolin-2-yl)-phenylmethanone is COc1cc2nc(C(=O)c3ccccc3)cn2c2ccc(C)cc12.
What is the InChIKey of (5-methoxy-7-methylimidazo[1,2-a]quinolin-2-yl)-phenylmethanone?
The InChIKey is VWMRGUFQLUIYBP-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H16N2O2/c1-13-8-9-17-15(10-13)18(24-2)11-19-21-16(12-22(17)19)20(23)14-6-4-3-5-7-14/h3-12H,1-2H3.
What are the key properties of (5-methoxy-7-methylimidazo[1,2-a]quinolin-2-yl)-phenylmethanone?
(5-methoxy-7-methylimidazo[1,2-a]quinolin-2-yl)-phenylmethanone has a molecular weight of 316.36 g/mol, XLogP of 4.04, 3 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for (5-methoxy-7-methylimidazo[1,2-a]quinolin-2-yl)-phenylmethanone is sourced from PubChem (CID 13055764), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).