4-(2-ethylbutylamino)-1-methyl-3,4-dihydroquinolin-2-one

C16H24N2O — CID 115718008

IUPAC4-(2-ethylbutylamino)-1-methyl-3,4-dihydroquinolin-2-one
SMILESCCC(CC)CNC1CC(=O)N(C)c2ccccc21
InChIInChI=1S/C16H24N2O/c1-4-12(5-2)11-17-14-10-16(19)18(3)15-9-7-6-8-13(14)15/h6-9,12,14,17H,4-5,10-11H2,1-3H3
InChIKeyFOENAQCPLOOQRV-UHFFFAOYSA-N
MW260.38 g/mol
LogP3.12
Rot. Bonds5

About 4-(2-ethylbutylamino)-1-methyl-3,4-dihydroquinolin-2-one

4-(2-ethylbutylamino)-1-methyl-3,4-dihydroquinolin-2-one (PubChem CID 115718008) has the molecular formula C16H24N2O and a molecular weight of 260.38 g/mol. Its IUPAC name is 4-(2-ethylbutylamino)-1-methyl-3,4-dihydroquinolin-2-one.

Molecular Properties

Compound Name4-(2-ethylbutylamino)-1-methyl-3,4-dihydroquinolin-2-one
PubChem CID115718008
Molecular FormulaC16H24N2O
Molecular Weight260.38 g/mol
Exact Mass260.19
IUPAC Name4-(2-ethylbutylamino)-1-methyl-3,4-dihydroquinolin-2-one
SMILESCCC(CC)CNC1CC(=O)N(C)c2ccccc21
InChIInChI=1S/C16H24N2O/c1-4-12(5-2)11-17-14-10-16(19)18(3)15-9-7-6-8-13(14)15/h6-9,12,14,17H,4-5,10-11H2,1-3H3
InChIKeyFOENAQCPLOOQRV-UHFFFAOYSA-N
XLogP3.12
TPSA32.34 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds5
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500260.38
LogP ≤ 53.12
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Analyze 4-(2-ethylbutylamino)-1-methyl-3,4-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

4-(2-hydroxypropylamino)-1-methyl-3,4-dihydroquinolin-2-one
CID 43776299
1-methyl-4-(2-methylsulfanylpropylamino)-3,4-dihydroquinolin-2-one
CID 115895572
1-methyl-4-(pentan-3-ylamino)-3,4-dihydroquinolin-2-one
CID 43756603
4-[(2-hydroxy-4,4-dimethylpentyl)amino]-1-methyl-3,4-dihydroquinolin-2-one
CID 103784381
4-(hexan-3-ylamino)-1-methyl-3,4-dihydroquinolin-2-one
CID 62119112
1-methyl-4-[(1-propan-2-ylcyclopropyl)methylamino]-3,4-dihydroquinolin-2-one
CID 103903270
4-[(2-hydroxy-2-methylbutyl)amino]-1-methyl-3,4-dihydroquinolin-2-one
CID 65102974
4-(cyclobutylmethylamino)-1-methyl-3,4-dihydroquinolin-2-one
CID 43775263
4-[(4-hydroxyphenyl)methylamino]-1-methyl-3,4-dihydroquinolin-2-one
CID 115715625
4-[(2-fluorophenyl)methylamino]-1-methyl-3,4-dihydroquinolin-2-one
CID 43763715
1-methyl-4-(3-methylsulfanylpropylamino)-3,4-dihydroquinolin-2-one
CID 63981224
1-methyl-4-(3-propoxypropylamino)-3,4-dihydroquinolin-2-one
CID 82940528

Frequently Asked Questions

What is the IUPAC name of 4-(2-ethylbutylamino)-1-methyl-3,4-dihydroquinolin-2-one?
The IUPAC name of 4-(2-ethylbutylamino)-1-methyl-3,4-dihydroquinolin-2-one (CID 115718008) is 4-(2-ethylbutylamino)-1-methyl-3,4-dihydroquinolin-2-one.
What is the SMILES notation for 4-(2-ethylbutylamino)-1-methyl-3,4-dihydroquinolin-2-one?
The canonical SMILES for 4-(2-ethylbutylamino)-1-methyl-3,4-dihydroquinolin-2-one is CCC(CC)CNC1CC(=O)N(C)c2ccccc21.
What is the InChIKey of 4-(2-ethylbutylamino)-1-methyl-3,4-dihydroquinolin-2-one?
The InChIKey is FOENAQCPLOOQRV-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H24N2O/c1-4-12(5-2)11-17-14-10-16(19)18(3)15-9-7-6-8-13(14)15/h6-9,12,14,17H,4-5,10-11H2,1-3H3.
What are the key properties of 4-(2-ethylbutylamino)-1-methyl-3,4-dihydroquinolin-2-one?
4-(2-ethylbutylamino)-1-methyl-3,4-dihydroquinolin-2-one has a molecular weight of 260.38 g/mol, XLogP of 3.12, 5 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 4-(2-ethylbutylamino)-1-methyl-3,4-dihydroquinolin-2-one is sourced from PubChem (CID 115718008), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).