(7-ethyl-5-methoxyimidazo[1,2-a]quinolin-2-yl)-phenylmethanone

C21H18N2O2 — CID 10314568

IUPAC(7-ethyl-5-methoxyimidazo[1,2-a]quinolin-2-yl)-phenylmethanone
SMILESCCc1ccc2c(c1)c(OC)cc1nc(C(=O)c3ccccc3)cn12
InChIInChI=1S/C21H18N2O2/c1-3-14-9-10-18-16(11-14)19(25-2)12-20-22-17(13-23(18)20)21(24)15-7-5-4-6-8-15/h4-13H,3H2,1-2H3
InChIKeyATAQGXABHTXTDL-UHFFFAOYSA-N
MW330.39 g/mol
LogP4.29
Rot. Bonds4

About (7-ethyl-5-methoxyimidazo[1,2-a]quinolin-2-yl)-phenylmethanone

(7-ethyl-5-methoxyimidazo[1,2-a]quinolin-2-yl)-phenylmethanone (PubChem CID 10314568) has the molecular formula C21H18N2O2 and a molecular weight of 330.39 g/mol. Its IUPAC name is (7-ethyl-5-methoxyimidazo[1,2-a]quinolin-2-yl)-phenylmethanone.

Molecular Properties

Compound Name(7-ethyl-5-methoxyimidazo[1,2-a]quinolin-2-yl)-phenylmethanone
PubChem CID10314568
Molecular FormulaC21H18N2O2
Molecular Weight330.39 g/mol
Exact Mass330.14
IUPAC Name(7-ethyl-5-methoxyimidazo[1,2-a]quinolin-2-yl)-phenylmethanone
SMILESCCc1ccc2c(c1)c(OC)cc1nc(C(=O)c3ccccc3)cn12
InChIInChI=1S/C21H18N2O2/c1-3-14-9-10-18-16(11-14)19(25-2)12-20-22-17(13-23(18)20)21(24)15-7-5-4-6-8-15/h4-13H,3H2,1-2H3
InChIKeyATAQGXABHTXTDL-UHFFFAOYSA-N
XLogP4.29
TPSA43.60 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms25
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500330.39
LogP ≤ 54.29
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of (7-ethyl-5-methoxyimidazo[1,2-a]quinolin-2-yl)-phenylmethanone?
The IUPAC name of (7-ethyl-5-methoxyimidazo[1,2-a]quinolin-2-yl)-phenylmethanone (CID 10314568) is (7-ethyl-5-methoxyimidazo[1,2-a]quinolin-2-yl)-phenylmethanone.
What is the SMILES notation for (7-ethyl-5-methoxyimidazo[1,2-a]quinolin-2-yl)-phenylmethanone?
The canonical SMILES for (7-ethyl-5-methoxyimidazo[1,2-a]quinolin-2-yl)-phenylmethanone is CCc1ccc2c(c1)c(OC)cc1nc(C(=O)c3ccccc3)cn12.
What is the InChIKey of (7-ethyl-5-methoxyimidazo[1,2-a]quinolin-2-yl)-phenylmethanone?
The InChIKey is ATAQGXABHTXTDL-UHFFFAOYSA-N. The full InChI is InChI=1S/C21H18N2O2/c1-3-14-9-10-18-16(11-14)19(25-2)12-20-22-17(13-23(18)20)21(24)15-7-5-4-6-8-15/h4-13H,3H2,1-2H3.
What are the key properties of (7-ethyl-5-methoxyimidazo[1,2-a]quinolin-2-yl)-phenylmethanone?
(7-ethyl-5-methoxyimidazo[1,2-a]quinolin-2-yl)-phenylmethanone has a molecular weight of 330.39 g/mol, XLogP of 4.29, 4 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for (7-ethyl-5-methoxyimidazo[1,2-a]quinolin-2-yl)-phenylmethanone is sourced from PubChem (CID 10314568), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).