4-amino-7-propan-2-yl-3,4-dihydro-1H-quinolin-2-one

C12H16N2O — CID 82158310

IUPAC4-amino-7-propan-2-yl-3,4-dihydro-1H-quinolin-2-one
SMILESCC(C)c1ccc2c(c1)NC(=O)CC2N
InChIInChI=1S/C12H16N2O/c1-7(2)8-3-4-9-10(13)6-12(15)14-11(9)5-8/h3-5,7,10H,6,13H2,1-2H3,(H,14,15)
InChIKeyPEEGGOOVZGAGKJ-UHFFFAOYSA-N
MW204.27 g/mol
LogP2.15
Rot. Bonds1

About 4-amino-7-propan-2-yl-3,4-dihydro-1H-quinolin-2-one

4-amino-7-propan-2-yl-3,4-dihydro-1H-quinolin-2-one (PubChem CID 82158310) has the molecular formula C12H16N2O and a molecular weight of 204.27 g/mol. Its IUPAC name is 4-amino-7-propan-2-yl-3,4-dihydro-1H-quinolin-2-one.

Molecular Properties

Compound Name4-amino-7-propan-2-yl-3,4-dihydro-1H-quinolin-2-one
PubChem CID82158310
Molecular FormulaC12H16N2O
Molecular Weight204.27 g/mol
Exact Mass204.13
IUPAC Name4-amino-7-propan-2-yl-3,4-dihydro-1H-quinolin-2-one
SMILESCC(C)c1ccc2c(c1)NC(=O)CC2N
InChIInChI=1S/C12H16N2O/c1-7(2)8-3-4-9-10(13)6-12(15)14-11(9)5-8/h3-5,7,10H,6,13H2,1-2H3,(H,14,15)
InChIKeyPEEGGOOVZGAGKJ-UHFFFAOYSA-N
XLogP2.15
TPSA55.12 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds1
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500204.27
LogP ≤ 52.15
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

Analyze 4-amino-7-propan-2-yl-3,4-dihydro-1H-quinolin-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-amino-7-chloro-3,4-dihydro-1H-quinolin-2-one
CID 82158219
7-propan-2-yl-3,4-dihydro-1H-quinoxalin-2-one
CID 84618877
molecular hydrogen;7-propan-2-yl-1,5-dihydro-1,5-benzodiazepine-2,4-dione
CID 176993371
9-(4-propan-2-ylphenyl)-3,6,8,9-tetrahydro-2H-[1,4]dioxino[2,3-g]quinolin-7-one
CID 4078264
methane;5-propan-2-yl-1,3-dihydroindol-2-one
CID 160830162
3-amino-6-propan-2-yl-2,3-dihydroisoindol-1-one
CID 163815026
8-methyl-5-propan-2-yl-1,3,4,5-tetrahydro-1-benzazepin-2-one
CID 10443350
6-propan-2-yl-1,2,3,4-tetrahydroquinolin-4-amine
CID 82275604
(5S)-5-amino-8-(3-methylphenyl)-1,3,4,5-tetrahydro-1-benzazepin-2-one
CID 57067545
5,7-dimethoxy-4-(4-propan-2-ylphenyl)-3,4-dihydro-1H-quinolin-2-one
CID 17312453
6-propan-2-ylspiro[1,4-dihydroquinoxaline-3,1'-cyclopentane]-2-one
CID 169049710
(2aS)-5-propan-2-yl-2,2a,3,7b-tetrahydro-1H-cyclobuta[b]indole
CID 167022988

Frequently Asked Questions

What is the IUPAC name of 4-amino-7-propan-2-yl-3,4-dihydro-1H-quinolin-2-one?
The IUPAC name of 4-amino-7-propan-2-yl-3,4-dihydro-1H-quinolin-2-one (CID 82158310) is 4-amino-7-propan-2-yl-3,4-dihydro-1H-quinolin-2-one.
What is the SMILES notation for 4-amino-7-propan-2-yl-3,4-dihydro-1H-quinolin-2-one?
The canonical SMILES for 4-amino-7-propan-2-yl-3,4-dihydro-1H-quinolin-2-one is CC(C)c1ccc2c(c1)NC(=O)CC2N.
What is the InChIKey of 4-amino-7-propan-2-yl-3,4-dihydro-1H-quinolin-2-one?
The InChIKey is PEEGGOOVZGAGKJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H16N2O/c1-7(2)8-3-4-9-10(13)6-12(15)14-11(9)5-8/h3-5,7,10H,6,13H2,1-2H3,(H,14,15).
What are the key properties of 4-amino-7-propan-2-yl-3,4-dihydro-1H-quinolin-2-one?
4-amino-7-propan-2-yl-3,4-dihydro-1H-quinolin-2-one has a molecular weight of 204.27 g/mol, XLogP of 2.15, 1 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 4-amino-7-propan-2-yl-3,4-dihydro-1H-quinolin-2-one is sourced from PubChem (CID 82158310), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).