(2-ethylphenyl)-quinolin-8-ylmethanone

C18H15NO — CID 115790630

IUPAC(2-ethylphenyl)-quinolin-8-ylmethanone
SMILESCCc1ccccc1C(=O)c1cccc2cccnc12
InChIInChI=1S/C18H15NO/c1-2-13-7-3-4-10-15(13)18(20)16-11-5-8-14-9-6-12-19-17(14)16/h3-12H,2H2,1H3
InChIKeyLIWMOMNZXFFJHV-UHFFFAOYSA-N
MW261.32 g/mol
LogP4.03
Rot. Bonds3

About (2-ethylphenyl)-quinolin-8-ylmethanone

(2-ethylphenyl)-quinolin-8-ylmethanone (PubChem CID 115790630) has the molecular formula C18H15NO and a molecular weight of 261.32 g/mol. Its IUPAC name is (2-ethylphenyl)-quinolin-8-ylmethanone.

Molecular Properties

Compound Name(2-ethylphenyl)-quinolin-8-ylmethanone
PubChem CID115790630
Molecular FormulaC18H15NO
Molecular Weight261.32 g/mol
Exact Mass261.12
IUPAC Name(2-ethylphenyl)-quinolin-8-ylmethanone
SMILESCCc1ccccc1C(=O)c1cccc2cccnc12
InChIInChI=1S/C18H15NO/c1-2-13-7-3-4-10-15(13)18(20)16-11-5-8-14-9-6-12-19-17(14)16/h3-12H,2H2,1H3
InChIKeyLIWMOMNZXFFJHV-UHFFFAOYSA-N
XLogP4.03
TPSA29.96 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500261.32
LogP ≤ 54.03
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Related Compounds

(2-methoxyphenyl)-quinolin-8-ylmethanone
CID 81215631
pyrimidin-2-yl(quinolin-8-yl)methanone
CID 81220703
[2-(2-methylidenebutoxy)phenyl]-quinolin-8-ylmethanone
CID 102035670
2-phenyl-1-quinolin-8-ylethanone
CID 10999362
(2,4-dimethylphenyl)-quinolin-8-ylmethanone
CID 115604843
(1,3-diethylpyrazol-5-yl)-quinolin-8-ylmethanone
CID 105121799
N-[(2-hydroxyphenyl)methyl]quinoline-8-carboxamide
CID 115598832
(2,5-dimethylfuran-3-yl)-quinolin-8-ylmethanone
CID 113230028
palladium;quinoline-8-carboxylic acid
CID 174945118
(4-tert-butylphenyl)-quinolin-8-ylmethanone
CID 102581511
2-ethylsulfanyl-1-quinolin-8-ylethanone
CID 81220485
(2,4-dichlorophenyl)-quinolin-8-ylmethanone
CID 115604879

Frequently Asked Questions

What is the IUPAC name of (2-ethylphenyl)-quinolin-8-ylmethanone?
The IUPAC name of (2-ethylphenyl)-quinolin-8-ylmethanone (CID 115790630) is (2-ethylphenyl)-quinolin-8-ylmethanone.
What is the SMILES notation for (2-ethylphenyl)-quinolin-8-ylmethanone?
The canonical SMILES for (2-ethylphenyl)-quinolin-8-ylmethanone is CCc1ccccc1C(=O)c1cccc2cccnc12.
What is the InChIKey of (2-ethylphenyl)-quinolin-8-ylmethanone?
The InChIKey is LIWMOMNZXFFJHV-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H15NO/c1-2-13-7-3-4-10-15(13)18(20)16-11-5-8-14-9-6-12-19-17(14)16/h3-12H,2H2,1H3.
What are the key properties of (2-ethylphenyl)-quinolin-8-ylmethanone?
(2-ethylphenyl)-quinolin-8-ylmethanone has a molecular weight of 261.32 g/mol, XLogP of 4.03, 3 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for (2-ethylphenyl)-quinolin-8-ylmethanone is sourced from PubChem (CID 115790630), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).