2-(4-ethylphenyl)-1-quinolin-2-ylethanone

C19H17NO — CID 63409967

IUPAC2-(4-ethylphenyl)-1-quinolin-2-ylethanone
SMILESCCc1ccc(CC(=O)c2ccc3ccccc3n2)cc1
InChIInChI=1S/C19H17NO/c1-2-14-7-9-15(10-8-14)13-19(21)18-12-11-16-5-3-4-6-17(16)20-18/h3-12H,2,13H2,1H3
InChIKeyCVFKRHCCCFPADC-UHFFFAOYSA-N
MW275.35 g/mol
LogP4.22
Rot. Bonds4

About 2-(4-ethylphenyl)-1-quinolin-2-ylethanone

2-(4-ethylphenyl)-1-quinolin-2-ylethanone (PubChem CID 63409967) has the molecular formula C19H17NO and a molecular weight of 275.35 g/mol. Its IUPAC name is 2-(4-ethylphenyl)-1-quinolin-2-ylethanone.

Molecular Properties

Compound Name2-(4-ethylphenyl)-1-quinolin-2-ylethanone
PubChem CID63409967
Molecular FormulaC19H17NO
Molecular Weight275.35 g/mol
Exact Mass275.13
IUPAC Name2-(4-ethylphenyl)-1-quinolin-2-ylethanone
SMILESCCc1ccc(CC(=O)c2ccc3ccccc3n2)cc1
InChIInChI=1S/C19H17NO/c1-2-14-7-9-15(10-8-14)13-19(21)18-12-11-16-5-3-4-6-17(16)20-18/h3-12H,2,13H2,1H3
InChIKeyCVFKRHCCCFPADC-UHFFFAOYSA-N
XLogP4.22
TPSA29.96 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500275.35
LogP ≤ 54.22
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Related Compounds

2-(4-chlorophenyl)-1-quinolin-2-ylethanone
CID 63222375
2-(5-ethyl-2-pyridinyl)-1-quinolin-2-ylethanone
CID 79732159
2-(5-ethylthiophen-2-yl)-1-quinolin-2-ylethanone
CID 63222293
2-(3,5-difluorophenyl)-1-quinolin-2-ylethanone
CID 105405253
1-quinolin-2-ylbutan-1-one
CID 14895778
1,2-di(quinolin-2-yl)ethanone
CID 24973307
2-amino-1-quinolin-2-ylethanone
CID 23532024
3-methyl-1-quinolin-2-ylbut-3-en-1-one
CID 79177139
[(2S)-1-(4-ethylanilino)-1-oxopropan-2-yl] quinoline-2-carboxylate
CID 2358161
3-methyl-1-quinolin-2-ylhexan-1-one
CID 63222374
3-methylsulfonyl-1-quinolin-2-ylpropan-1-one
CID 63222455
2-(5-bromo-2-pyridinyl)-1-quinolin-2-ylethanone
CID 104798887

Frequently Asked Questions

What is the IUPAC name of 2-(4-ethylphenyl)-1-quinolin-2-ylethanone?
The IUPAC name of 2-(4-ethylphenyl)-1-quinolin-2-ylethanone (CID 63409967) is 2-(4-ethylphenyl)-1-quinolin-2-ylethanone.
What is the SMILES notation for 2-(4-ethylphenyl)-1-quinolin-2-ylethanone?
The canonical SMILES for 2-(4-ethylphenyl)-1-quinolin-2-ylethanone is CCc1ccc(CC(=O)c2ccc3ccccc3n2)cc1.
What is the InChIKey of 2-(4-ethylphenyl)-1-quinolin-2-ylethanone?
The InChIKey is CVFKRHCCCFPADC-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H17NO/c1-2-14-7-9-15(10-8-14)13-19(21)18-12-11-16-5-3-4-6-17(16)20-18/h3-12H,2,13H2,1H3.
What are the key properties of 2-(4-ethylphenyl)-1-quinolin-2-ylethanone?
2-(4-ethylphenyl)-1-quinolin-2-ylethanone has a molecular weight of 275.35 g/mol, XLogP of 4.22, 4 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(4-ethylphenyl)-1-quinolin-2-ylethanone is sourced from PubChem (CID 63409967), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).