7-amino-4aH-quinolin-2-one

C9H8N2O — CID 73473129

IUPAC7-amino-4aH-quinolin-2-one
SMILESNC1=CC2=NC(=O)C=CC2C=C1
InChIInChI=1S/C9H8N2O/c10-7-3-1-6-2-4-9(12)11-8(6)5-7/h1-6H,10H2
InChIKeyOGQCTFSNHDMJRP-UHFFFAOYSA-N
MW160.18 g/mol
LogP0.55
Rot. Bonds

About 7-amino-4aH-quinolin-2-one

7-amino-4aH-quinolin-2-one (PubChem CID 73473129) has the molecular formula C9H8N2O and a molecular weight of 160.18 g/mol. Its IUPAC name is 7-amino-4aH-quinolin-2-one.

Molecular Properties

Compound Name7-amino-4aH-quinolin-2-one
PubChem CID73473129
Molecular FormulaC9H8N2O
Molecular Weight160.18 g/mol
Exact Mass160.06
IUPAC Name7-amino-4aH-quinolin-2-one
SMILESNC1=CC2=NC(=O)C=CC2C=C1
InChIInChI=1S/C9H8N2O/c10-7-3-1-6-2-4-9(12)11-8(6)5-7/h1-6H,10H2
InChIKeyOGQCTFSNHDMJRP-UHFFFAOYSA-N
XLogP0.55
TPSA55.45 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500160.18
LogP ≤ 50.55
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Analyze 7-amino-4aH-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

Aminobenzazepinone
CID 22243685
4-Amino-1-benzazepin-2-one
CID 91371396
7-amino-4-(trifluoromethyl)-4aH-quinolin-2-one
CID 78173897
6-Aminoindol-2-one
CID 19844541
6-Amino-1-benzazepin-2-one
CID 19919654
5-Aminoindole-2-one
CID 53423911
8-Amino-benzoazepin-2-one
CID 86634086
6-amino-3H-quinolin-2-one
CID 90852821
3-Aminocyclohepta[b]pyridin-2-one
CID 176071291
2-amino-6aH-phenanthridin-6-one
CID 45024318
7-amino-4-methyl-4aH-quinolin-2-one
CID 71304004
6-amino-4aH-quinolin-2-one
CID 72218604

Frequently Asked Questions

What is the IUPAC name of 7-amino-4aH-quinolin-2-one?
The IUPAC name of 7-amino-4aH-quinolin-2-one (CID 73473129) is 7-amino-4aH-quinolin-2-one.
What is the SMILES notation for 7-amino-4aH-quinolin-2-one?
The canonical SMILES for 7-amino-4aH-quinolin-2-one is NC1=CC2=NC(=O)C=CC2C=C1.
What is the InChIKey of 7-amino-4aH-quinolin-2-one?
The InChIKey is OGQCTFSNHDMJRP-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H8N2O/c10-7-3-1-6-2-4-9(12)11-8(6)5-7/h1-6H,10H2.
What are the key properties of 7-amino-4aH-quinolin-2-one?
7-amino-4aH-quinolin-2-one has a molecular weight of 160.18 g/mol, XLogP of 0.55, 0 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 7-amino-4aH-quinolin-2-one is sourced from PubChem (CID 73473129), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).