(7-ethylquinolin-3-yl)-(2-hydroxyphenyl)methanone

C18H15NO2 — CID 139223032

IUPAC(7-ethylquinolin-3-yl)-(2-hydroxyphenyl)methanone
SMILESCCc1ccc2cc(C(=O)c3ccccc3O)cnc2c1
InChIInChI=1S/C18H15NO2/c1-2-12-7-8-13-10-14(11-19-16(13)9-12)18(21)15-5-3-4-6-17(15)20/h3-11,20H,2H2,1H3
InChIKeyBACPWLTVHKSSMV-UHFFFAOYSA-N
MW277.32 g/mol
LogP3.73
Rot. Bonds3

About (7-ethylquinolin-3-yl)-(2-hydroxyphenyl)methanone

(7-ethylquinolin-3-yl)-(2-hydroxyphenyl)methanone (PubChem CID 139223032) has the molecular formula C18H15NO2 and a molecular weight of 277.32 g/mol. Its IUPAC name is (7-ethylquinolin-3-yl)-(2-hydroxyphenyl)methanone.

Molecular Properties

Compound Name(7-ethylquinolin-3-yl)-(2-hydroxyphenyl)methanone
PubChem CID139223032
Molecular FormulaC18H15NO2
Molecular Weight277.32 g/mol
Exact Mass277.11
IUPAC Name(7-ethylquinolin-3-yl)-(2-hydroxyphenyl)methanone
SMILESCCc1ccc2cc(C(=O)c3ccccc3O)cnc2c1
InChIInChI=1S/C18H15NO2/c1-2-12-7-8-13-10-14(11-19-16(13)9-12)18(21)15-5-3-4-6-17(15)20/h3-11,20H,2H2,1H3
InChIKeyBACPWLTVHKSSMV-UHFFFAOYSA-N
XLogP3.73
TPSA50.19 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500277.32
LogP ≤ 53.73
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of (7-ethylquinolin-3-yl)-(2-hydroxyphenyl)methanone?
The IUPAC name of (7-ethylquinolin-3-yl)-(2-hydroxyphenyl)methanone (CID 139223032) is (7-ethylquinolin-3-yl)-(2-hydroxyphenyl)methanone.
What is the SMILES notation for (7-ethylquinolin-3-yl)-(2-hydroxyphenyl)methanone?
The canonical SMILES for (7-ethylquinolin-3-yl)-(2-hydroxyphenyl)methanone is CCc1ccc2cc(C(=O)c3ccccc3O)cnc2c1.
What is the InChIKey of (7-ethylquinolin-3-yl)-(2-hydroxyphenyl)methanone?
The InChIKey is BACPWLTVHKSSMV-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H15NO2/c1-2-12-7-8-13-10-14(11-19-16(13)9-12)18(21)15-5-3-4-6-17(15)20/h3-11,20H,2H2,1H3.
What are the key properties of (7-ethylquinolin-3-yl)-(2-hydroxyphenyl)methanone?
(7-ethylquinolin-3-yl)-(2-hydroxyphenyl)methanone has a molecular weight of 277.32 g/mol, XLogP of 3.73, 3 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for (7-ethylquinolin-3-yl)-(2-hydroxyphenyl)methanone is sourced from PubChem (CID 139223032), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).