7-(dimethylamino)-4-methyl-4aH-quinolin-2-one

C12H14N2O — CID 77199558

IUPAC7-(dimethylamino)-4-methyl-4aH-quinolin-2-one
SMILESCC1=CC(=O)N=C2C=C(N(C)C)C=CC12
InChIInChI=1S/C12H14N2O/c1-8-6-12(15)13-11-7-9(14(2)3)4-5-10(8)11/h4-7,10H,1-3H3
InChIKeyITENNABZPCRDGB-UHFFFAOYSA-N
MW202.26 g/mol
LogP1.55
Rot. Bonds1

About 7-(dimethylamino)-4-methyl-4aH-quinolin-2-one

7-(dimethylamino)-4-methyl-4aH-quinolin-2-one (PubChem CID 77199558) has the molecular formula C12H14N2O and a molecular weight of 202.26 g/mol. Its IUPAC name is 7-(dimethylamino)-4-methyl-4aH-quinolin-2-one.

Molecular Properties

Compound Name7-(dimethylamino)-4-methyl-4aH-quinolin-2-one
PubChem CID77199558
Molecular FormulaC12H14N2O
Molecular Weight202.26 g/mol
Exact Mass202.11
IUPAC Name7-(dimethylamino)-4-methyl-4aH-quinolin-2-one
SMILESCC1=CC(=O)N=C2C=C(N(C)C)C=CC12
InChIInChI=1S/C12H14N2O/c1-8-6-12(15)13-11-7-9(14(2)3)4-5-10(8)11/h4-7,10H,1-3H3
InChIKeyITENNABZPCRDGB-UHFFFAOYSA-N
XLogP1.55
TPSA32.67 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds1
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500202.26
LogP ≤ 51.55
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Related Compounds

1,2,9-Trimethyl-pyrrolo[3,2-f]quinol-7-one
CID 129791065
2,3,9-Trimethylpyrrolo[2,3-f]quinol-7-one
CID 129791208
2,3,5-Trimethylpyrrolo [3,2-g]-quinol-7-one
CID 129791355
3-fluoro-4-methyl-4aH-quinolin-2-one
CID 76130808
7-fluoro-4-methyl-4aH-quinolin-2-one
CID 76220766
8-fluoro-4-methyl-4aH-quinolin-2-one
CID 118797520
1,2,3-trimethyl-8-(trifluoromethyl)-8aH-pyrrolo[2,3-g]quinolin-6-one
CID 133563876
6-fluoro-4-methyl-4aH-quinolin-2-one
CID 178186131
3-Cyclohexa-2,4-dien-1-yl-7-methyl-2,7-naphthyridin-1-one
CID 143037796
Carbostyril Maleimide
CID 45038560
7-(dimethylamino)-3,4,5-trimethyl-6H-quinolin-2-one
CID 56608534
7-amino-4-methyl-4aH-quinolin-2-one
CID 71304004

Frequently Asked Questions

What is the IUPAC name of 7-(dimethylamino)-4-methyl-4aH-quinolin-2-one?
The IUPAC name of 7-(dimethylamino)-4-methyl-4aH-quinolin-2-one (CID 77199558) is 7-(dimethylamino)-4-methyl-4aH-quinolin-2-one.
What is the SMILES notation for 7-(dimethylamino)-4-methyl-4aH-quinolin-2-one?
The canonical SMILES for 7-(dimethylamino)-4-methyl-4aH-quinolin-2-one is CC1=CC(=O)N=C2C=C(N(C)C)C=CC12.
What is the InChIKey of 7-(dimethylamino)-4-methyl-4aH-quinolin-2-one?
The InChIKey is ITENNABZPCRDGB-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H14N2O/c1-8-6-12(15)13-11-7-9(14(2)3)4-5-10(8)11/h4-7,10H,1-3H3.
What are the key properties of 7-(dimethylamino)-4-methyl-4aH-quinolin-2-one?
7-(dimethylamino)-4-methyl-4aH-quinolin-2-one has a molecular weight of 202.26 g/mol, XLogP of 1.55, 1 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 7-(dimethylamino)-4-methyl-4aH-quinolin-2-one is sourced from PubChem (CID 77199558), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).