1,3-dimethyl-4-phenoxyquinolin-2-one

C17H15NO2 — CID 151532277

IUPAC1,3-dimethyl-4-phenoxyquinolin-2-one
SMILESCc1c(Oc2ccccc2)c2ccccc2n(C)c1=O
InChIInChI=1S/C17H15NO2/c1-12-16(20-13-8-4-3-5-9-13)14-10-6-7-11-15(14)18(2)17(12)19/h3-11H,1-2H3
InChIKeyPWSSLHICLMDNBD-UHFFFAOYSA-N
MW265.31 g/mol
LogP3.64
Rot. Bonds2

About 1,3-dimethyl-4-phenoxyquinolin-2-one

1,3-dimethyl-4-phenoxyquinolin-2-one (PubChem CID 151532277) has the molecular formula C17H15NO2 and a molecular weight of 265.31 g/mol. Its IUPAC name is 1,3-dimethyl-4-phenoxyquinolin-2-one.

Molecular Properties

Compound Name1,3-dimethyl-4-phenoxyquinolin-2-one
PubChem CID151532277
Molecular FormulaC17H15NO2
Molecular Weight265.31 g/mol
Exact Mass265.11
IUPAC Name1,3-dimethyl-4-phenoxyquinolin-2-one
SMILESCc1c(Oc2ccccc2)c2ccccc2n(C)c1=O
InChIInChI=1S/C17H15NO2/c1-12-16(20-13-8-4-3-5-9-13)14-10-6-7-11-15(14)18(2)17(12)19/h3-11H,1-2H3
InChIKeyPWSSLHICLMDNBD-UHFFFAOYSA-N
XLogP3.64
TPSA31.23 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500265.31
LogP ≤ 53.64
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

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Related Compounds

ethane;4-hydroxy-1,3-dimethylquinolin-2-one
CID 91565927
3-iodo-6-methyl-4-phenoxypyrano[3,2-c]quinoline-2,5-dione
CID 2784493
3-chloro-1,4-dimethylquinolin-2-one
CID 15643026
(3-acetyloxy-1-methyl-2-oxoquinolin-4-yl) acetate
CID 19776662
1-methyl-2-(4-methylphenoxy)indole-3-carbaldehyde
CID 2763797
methyl 2-(1,4-dimethyl-2-oxoquinolin-3-yl)acetate
CID 13405582
1,3-dimethyl-5-phenoxyindole-2-carbaldehyde
CID 82501585
4-(3-chlorophenyl)-1,3-dimethylquinolin-2-one
CID 22058094
2-(1,3-dimethylindol-2-yl)-1,3-dimethylindole
CID 12742686
3-bromo-1-methyl-4-phenylquinolin-2-one
CID 50999162
8-methyl-8-azapentacyclo[20.4.0.02,7.09,14.015,20]hexacosa-1(26),2,4,6,9,11,13,15,17,19,22,24-dodecaen-21-one
CID 167125984
ethane;1,2,3-trimethylindole
CID 91590745

Frequently Asked Questions

What is the IUPAC name of 1,3-dimethyl-4-phenoxyquinolin-2-one?
The IUPAC name of 1,3-dimethyl-4-phenoxyquinolin-2-one (CID 151532277) is 1,3-dimethyl-4-phenoxyquinolin-2-one.
What is the SMILES notation for 1,3-dimethyl-4-phenoxyquinolin-2-one?
The canonical SMILES for 1,3-dimethyl-4-phenoxyquinolin-2-one is Cc1c(Oc2ccccc2)c2ccccc2n(C)c1=O.
What is the InChIKey of 1,3-dimethyl-4-phenoxyquinolin-2-one?
The InChIKey is PWSSLHICLMDNBD-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H15NO2/c1-12-16(20-13-8-4-3-5-9-13)14-10-6-7-11-15(14)18(2)17(12)19/h3-11H,1-2H3.
What are the key properties of 1,3-dimethyl-4-phenoxyquinolin-2-one?
1,3-dimethyl-4-phenoxyquinolin-2-one has a molecular weight of 265.31 g/mol, XLogP of 3.64, 2 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 1,3-dimethyl-4-phenoxyquinolin-2-one is sourced from PubChem (CID 151532277), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).