4-(2,6-dimethylphenyl)-1-methylquinolin-2-one

C18H17NO — CID 135055452

IUPAC4-(2,6-dimethylphenyl)-1-methylquinolin-2-one
SMILESCc1cccc(C)c1-c1cc(=O)n(C)c2ccccc12
InChIInChI=1S/C18H17NO/c1-12-7-6-8-13(2)18(12)15-11-17(20)19(3)16-10-5-4-9-14(15)16/h4-11H,1-3H3
InChIKeyUGNFPFLBMXXCNO-UHFFFAOYSA-N
MW263.34 g/mol
LogP3.82
Rot. Bonds1

About 4-(2,6-dimethylphenyl)-1-methylquinolin-2-one

4-(2,6-dimethylphenyl)-1-methylquinolin-2-one (PubChem CID 135055452) has the molecular formula C18H17NO and a molecular weight of 263.34 g/mol. Its IUPAC name is 4-(2,6-dimethylphenyl)-1-methylquinolin-2-one.

Molecular Properties

Compound Name4-(2,6-dimethylphenyl)-1-methylquinolin-2-one
PubChem CID135055452
Molecular FormulaC18H17NO
Molecular Weight263.34 g/mol
Exact Mass263.13
IUPAC Name4-(2,6-dimethylphenyl)-1-methylquinolin-2-one
SMILESCc1cccc(C)c1-c1cc(=O)n(C)c2ccccc12
InChIInChI=1S/C18H17NO/c1-12-7-6-8-13(2)18(12)15-11-17(20)19(3)16-10-5-4-9-14(15)16/h4-11H,1-3H3
InChIKeyUGNFPFLBMXXCNO-UHFFFAOYSA-N
XLogP3.82
TPSA22.00 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds1
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500263.34
LogP ≤ 53.82
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Related Compounds

1,5-dimethylquinolin-2-one
CID 19387899
1-methyl-4-(4-methylphenyl)sulfanylquinolin-2-one
CID 46926579
N-(2,3-dimethylphenyl)-1-methyl-2-oxoquinoline-4-carboxamide
CID 110694521
4-(1,2-dihydropyridin-4-yl)-1-methylquinolin-2-one
CID 143221630
4-(4-bromophenyl)sulfanyl-1-methylquinolin-2-one
CID 24895941
4-(diethylamino)-1-methylquinolin-2-one
CID 121227285
1-methyl-5-(methylamino)quinolin-2-one
CID 138477987
4-[2-aminoethyl(methyl)amino]-1-methylquinolin-2-one
CID 81237815
1-methyl-4-[(3-methyl-2-pyridinyl)methylamino]quinolin-2-one
CID 81244773
1-methyl-4-piperidin-1-ylquinolin-2-one
CID 154146370
3,4-bis(1,2-dimethylindol-3-yl)cyclobut-3-ene-1,2-dione
CID 126480670
4-(3-benzyl-1,2,4-oxadiazol-5-yl)-1-methylquinolin-2-one
CID 166201066

Frequently Asked Questions

What is the IUPAC name of 4-(2,6-dimethylphenyl)-1-methylquinolin-2-one?
The IUPAC name of 4-(2,6-dimethylphenyl)-1-methylquinolin-2-one (CID 135055452) is 4-(2,6-dimethylphenyl)-1-methylquinolin-2-one.
What is the SMILES notation for 4-(2,6-dimethylphenyl)-1-methylquinolin-2-one?
The canonical SMILES for 4-(2,6-dimethylphenyl)-1-methylquinolin-2-one is Cc1cccc(C)c1-c1cc(=O)n(C)c2ccccc12.
What is the InChIKey of 4-(2,6-dimethylphenyl)-1-methylquinolin-2-one?
The InChIKey is UGNFPFLBMXXCNO-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H17NO/c1-12-7-6-8-13(2)18(12)15-11-17(20)19(3)16-10-5-4-9-14(15)16/h4-11H,1-3H3.
What are the key properties of 4-(2,6-dimethylphenyl)-1-methylquinolin-2-one?
4-(2,6-dimethylphenyl)-1-methylquinolin-2-one has a molecular weight of 263.34 g/mol, XLogP of 3.82, 1 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 4-(2,6-dimethylphenyl)-1-methylquinolin-2-one is sourced from PubChem (CID 135055452), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).