6-(methylamino)-1-[3-(methylamino)propanoyl]-3,4-dihydroquinolin-2-one

C14H19N3O2 — CID 115153207

IUPAC6-(methylamino)-1-[3-(methylamino)propanoyl]-3,4-dihydroquinolin-2-one
SMILESCNCCC(=O)N1C(=O)CCc2cc(NC)ccc21
InChIInChI=1S/C14H19N3O2/c1-15-8-7-14(19)17-12-5-4-11(16-2)9-10(12)3-6-13(17)18/h4-5,9,15-16H,3,6-8H2,1-2H3
InChIKeyQVIQFQZTUWANPS-UHFFFAOYSA-N
MW261.32 g/mol
LogP1.14
Rot. Bonds4

About 6-(methylamino)-1-[3-(methylamino)propanoyl]-3,4-dihydroquinolin-2-one

6-(methylamino)-1-[3-(methylamino)propanoyl]-3,4-dihydroquinolin-2-one (PubChem CID 115153207) has the molecular formula C14H19N3O2 and a molecular weight of 261.32 g/mol. Its IUPAC name is 6-(methylamino)-1-[3-(methylamino)propanoyl]-3,4-dihydroquinolin-2-one.

Molecular Properties

Compound Name6-(methylamino)-1-[3-(methylamino)propanoyl]-3,4-dihydroquinolin-2-one
PubChem CID115153207
Molecular FormulaC14H19N3O2
Molecular Weight261.32 g/mol
Exact Mass261.15
IUPAC Name6-(methylamino)-1-[3-(methylamino)propanoyl]-3,4-dihydroquinolin-2-one
SMILESCNCCC(=O)N1C(=O)CCc2cc(NC)ccc21
InChIInChI=1S/C14H19N3O2/c1-15-8-7-14(19)17-12-5-4-11(16-2)9-10(12)3-6-13(17)18/h4-5,9,15-16H,3,6-8H2,1-2H3
InChIKeyQVIQFQZTUWANPS-UHFFFAOYSA-N
XLogP1.14
TPSA61.44 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500261.32
LogP ≤ 51.14
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

Analyze 6-(methylamino)-1-[3-(methylamino)propanoyl]-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

methyl 6-(methylamino)-2-oxo-3,4-dihydroquinoline-1-carboxylate
CID 115190471
1-(4-aminobutanoyl)-5-(methylamino)-3H-indol-2-one
CID 115155191
6-(methylamino)-1-(3-oxobutyl)-3,4-dihydroquinolin-2-one
CID 115235513
5-(methylamino)-2-oxo-3H-indole-1-carbonyl cyanide
CID 115172000
methyl 6-[2-(methylamino)ethyl]-2-oxo-3,4-dihydroquinoline-1-carboxylate
CID 115190786
4-[6-(methylamino)-2-oxo-3,4-dihydroquinolin-1-yl]-3-oxobutanenitrile
CID 117038333
6-(methylamino)-4-(3-sulfanylpropanoyl)-1,4-benzoxazin-3-one
CID 115167767
6-[2-(methylamino)ethyl]-2-oxo-3,4-dihydroquinoline-1-carbohydrazide
CID 115193038
6-(methylaminomethyl)-2-oxo-3,4-dihydroquinoline-1-carboxylic acid
CID 115170974
1-(2-amino-2-methylpropyl)-6-(methylamino)-3,4-dihydroquinolin-2-one
CID 115135758
6-(methylamino)-1-(3-sulfanylpropyl)-3,4-dihydroquinolin-2-one
CID 115224728
5-(aminomethyl)-1-[4-(methylamino)butanoyl]-3H-indol-2-one
CID 115155708

Frequently Asked Questions

What is the IUPAC name of 6-(methylamino)-1-[3-(methylamino)propanoyl]-3,4-dihydroquinolin-2-one?
The IUPAC name of 6-(methylamino)-1-[3-(methylamino)propanoyl]-3,4-dihydroquinolin-2-one (CID 115153207) is 6-(methylamino)-1-[3-(methylamino)propanoyl]-3,4-dihydroquinolin-2-one.
What is the SMILES notation for 6-(methylamino)-1-[3-(methylamino)propanoyl]-3,4-dihydroquinolin-2-one?
The canonical SMILES for 6-(methylamino)-1-[3-(methylamino)propanoyl]-3,4-dihydroquinolin-2-one is CNCCC(=O)N1C(=O)CCc2cc(NC)ccc21.
What is the InChIKey of 6-(methylamino)-1-[3-(methylamino)propanoyl]-3,4-dihydroquinolin-2-one?
The InChIKey is QVIQFQZTUWANPS-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H19N3O2/c1-15-8-7-14(19)17-12-5-4-11(16-2)9-10(12)3-6-13(17)18/h4-5,9,15-16H,3,6-8H2,1-2H3.
What are the key properties of 6-(methylamino)-1-[3-(methylamino)propanoyl]-3,4-dihydroquinolin-2-one?
6-(methylamino)-1-[3-(methylamino)propanoyl]-3,4-dihydroquinolin-2-one has a molecular weight of 261.32 g/mol, XLogP of 1.14, 4 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 6-(methylamino)-1-[3-(methylamino)propanoyl]-3,4-dihydroquinolin-2-one is sourced from PubChem (CID 115153207), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).