6-(3-aminopentyl)-3,4-dihydro-1H-quinolin-2-one

C14H20N2O — CID 82475336

IUPAC6-(3-aminopentyl)-3,4-dihydro-1H-quinolin-2-one
SMILESCCC(N)CCc1ccc2c(c1)CCC(=O)N2
InChIInChI=1S/C14H20N2O/c1-2-12(15)6-3-10-4-7-13-11(9-10)5-8-14(17)16-13/h4,7,9,12H,2-3,5-6,8,15H2,1H3,(H,16,17)
InChIKeyNJKSEVFMTUMPAV-UHFFFAOYSA-N
MW232.33 g/mol
LogP2.24
Rot. Bonds4

About 6-(3-aminopentyl)-3,4-dihydro-1H-quinolin-2-one

6-(3-aminopentyl)-3,4-dihydro-1H-quinolin-2-one (PubChem CID 82475336) has the molecular formula C14H20N2O and a molecular weight of 232.33 g/mol. Its IUPAC name is 6-(3-aminopentyl)-3,4-dihydro-1H-quinolin-2-one.

Molecular Properties

Compound Name6-(3-aminopentyl)-3,4-dihydro-1H-quinolin-2-one
PubChem CID82475336
Molecular FormulaC14H20N2O
Molecular Weight232.33 g/mol
Exact Mass232.16
IUPAC Name6-(3-aminopentyl)-3,4-dihydro-1H-quinolin-2-one
SMILESCCC(N)CCc1ccc2c(c1)CCC(=O)N2
InChIInChI=1S/C14H20N2O/c1-2-12(15)6-3-10-4-7-13-11(9-10)5-8-14(17)16-13/h4,7,9,12H,2-3,5-6,8,15H2,1H3,(H,16,17)
InChIKeyNJKSEVFMTUMPAV-UHFFFAOYSA-N
XLogP2.24
TPSA55.12 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500232.33
LogP ≤ 52.24
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

Analyze 6-(3-aminopentyl)-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

6-(2-aminopropyl)-3,4-dihydro-1H-quinolin-2-one
CID 82190762
6-(2-bromoethyl)-3,4-dihydro-1H-quinolin-2-one
CID 18382037
6-(2-sulfanylethyl)-3,4-dihydro-1H-quinolin-2-one
CID 82283516
6-[2-(methylamino)ethyl]-3,4-dihydro-1H-quinolin-2-one
CID 82282846
6-[2-[1-aminopropan-2-yl(methyl)amino]ethyl]-3,4-dihydro-1H-quinolin-2-one
CID 117040127
6-[2-[(2-amino-3-hydroxypropyl)amino]ethyl]-3,4-dihydro-1H-quinolin-2-one
CID 115120823
6-[[1-aminopropan-2-yl(methyl)amino]methyl]-3,4-dihydro-1H-quinolin-2-one
CID 117039998
3-amino-4-(2-oxo-3,4-dihydro-1H-quinolin-6-yl)butanoic acid
CID 82480198
6-(diaminomethyl)-3,4-dihydro-1H-quinolin-2-one
CID 116939160
7-(2-aminoethyl)-1,3,4,5-tetrahydro-1-benzazepin-2-one
CID 82190756
6-[(propan-2-ylamino)methyl]-3,4-dihydro-1H-quinolin-2-one
CID 82285548
2-(2-oxo-3,4-dihydro-1H-quinolin-6-yl)ethanesulfonyl chloride
CID 82488863

Frequently Asked Questions

What is the IUPAC name of 6-(3-aminopentyl)-3,4-dihydro-1H-quinolin-2-one?
The IUPAC name of 6-(3-aminopentyl)-3,4-dihydro-1H-quinolin-2-one (CID 82475336) is 6-(3-aminopentyl)-3,4-dihydro-1H-quinolin-2-one.
What is the SMILES notation for 6-(3-aminopentyl)-3,4-dihydro-1H-quinolin-2-one?
The canonical SMILES for 6-(3-aminopentyl)-3,4-dihydro-1H-quinolin-2-one is CCC(N)CCc1ccc2c(c1)CCC(=O)N2.
What is the InChIKey of 6-(3-aminopentyl)-3,4-dihydro-1H-quinolin-2-one?
The InChIKey is NJKSEVFMTUMPAV-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H20N2O/c1-2-12(15)6-3-10-4-7-13-11(9-10)5-8-14(17)16-13/h4,7,9,12H,2-3,5-6,8,15H2,1H3,(H,16,17).
What are the key properties of 6-(3-aminopentyl)-3,4-dihydro-1H-quinolin-2-one?
6-(3-aminopentyl)-3,4-dihydro-1H-quinolin-2-one has a molecular weight of 232.33 g/mol, XLogP of 2.24, 4 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 6-(3-aminopentyl)-3,4-dihydro-1H-quinolin-2-one is sourced from PubChem (CID 82475336), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).