4-ethyl-4-methyl-1,3-dihydroquinolin-2-one

C12H15NO — CID 126504944

IUPAC4-ethyl-4-methyl-1,3-dihydroquinolin-2-one
SMILESCCC1(C)CC(=O)Nc2ccccc21
InChIInChI=1S/C12H15NO/c1-3-12(2)8-11(14)13-10-7-5-4-6-9(10)12/h4-7H,3,8H2,1-2H3,(H,13,14)
InChIKeyAHBAAKLXVDJCJZ-UHFFFAOYSA-N
MW189.26 g/mol
LogP2.70
Rot. Bonds1

About 4-ethyl-4-methyl-1,3-dihydroquinolin-2-one

4-ethyl-4-methyl-1,3-dihydroquinolin-2-one (PubChem CID 126504944) has the molecular formula C12H15NO and a molecular weight of 189.26 g/mol. Its IUPAC name is 4-ethyl-4-methyl-1,3-dihydroquinolin-2-one.

Molecular Properties

Compound Name4-ethyl-4-methyl-1,3-dihydroquinolin-2-one
PubChem CID126504944
Molecular FormulaC12H15NO
Molecular Weight189.26 g/mol
Exact Mass189.12
IUPAC Name4-ethyl-4-methyl-1,3-dihydroquinolin-2-one
SMILESCCC1(C)CC(=O)Nc2ccccc21
InChIInChI=1S/C12H15NO/c1-3-12(2)8-11(14)13-10-7-5-4-6-9(10)12/h4-7H,3,8H2,1-2H3,(H,13,14)
InChIKeyAHBAAKLXVDJCJZ-UHFFFAOYSA-N
XLogP2.70
TPSA29.10 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds1
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500189.26
LogP ≤ 52.70
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

Analyze 4-ethyl-4-methyl-1,3-dihydroquinolin-2-one with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

6(5H)-Phenanthridinone
CID 1853
Hydrocarbostyril
CID 64796
6-(4-(trifluoromethyl)phenyl)-3,4-dihydroquinolin-2(1H)-one
CID 12000936
6(5h)-Phenanthridinone, 2-amino-
CID 270668
Buchapine
CID 461150
N-(2-Methylphenyl)benzeneacetamide
CID 38661
1,3,4,5-Tetrahydro-2H-1-benzazepin-2-one
CID 248580
N,2-Diphenylacetamide
CID 225533
3,3-Dimethyl-1,3-dihydro-indol-2-one
CID 313100
N-(2-oxo-3,4-dihydro-1H-quinolin-7-yl)cyclopropanecarboxamide
CID 1505866
Upcmld05admt002042
CID 316235
N-(4-(3-Ethyl-2,6-dioxo-3-piperidinyl)phenyl)acetamide
CID 38050

Frequently Asked Questions

What is the IUPAC name of 4-ethyl-4-methyl-1,3-dihydroquinolin-2-one?
The IUPAC name of 4-ethyl-4-methyl-1,3-dihydroquinolin-2-one (CID 126504944) is 4-ethyl-4-methyl-1,3-dihydroquinolin-2-one.
What is the SMILES notation for 4-ethyl-4-methyl-1,3-dihydroquinolin-2-one?
The canonical SMILES for 4-ethyl-4-methyl-1,3-dihydroquinolin-2-one is CCC1(C)CC(=O)Nc2ccccc21.
What is the InChIKey of 4-ethyl-4-methyl-1,3-dihydroquinolin-2-one?
The InChIKey is AHBAAKLXVDJCJZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H15NO/c1-3-12(2)8-11(14)13-10-7-5-4-6-9(10)12/h4-7H,3,8H2,1-2H3,(H,13,14).
What are the key properties of 4-ethyl-4-methyl-1,3-dihydroquinolin-2-one?
4-ethyl-4-methyl-1,3-dihydroquinolin-2-one has a molecular weight of 189.26 g/mol, XLogP of 2.70, 1 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 4-ethyl-4-methyl-1,3-dihydroquinolin-2-one is sourced from PubChem (CID 126504944), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).