6-[2-[1-aminopropan-2-yl(methyl)amino]ethyl]-3,4-dihydro-1H-quinolin-2-one

C15H23N3O — CID 117040127

IUPAC6-[2-[1-aminopropan-2-yl(methyl)amino]ethyl]-3,4-dihydro-1H-quinolin-2-one
SMILESCC(CN)N(C)CCc1ccc2c(c1)CCC(=O)N2
InChIInChI=1S/C15H23N3O/c1-11(10-16)18(2)8-7-12-3-5-14-13(9-12)4-6-15(19)17-14/h3,5,9,11H,4,6-8,10,16H2,1-2H3,(H,17,19)
InChIKeyXIDSIOWOIVESGN-UHFFFAOYSA-N
MW261.37 g/mol
LogP1.39
Rot. Bonds5

About 6-[2-[1-aminopropan-2-yl(methyl)amino]ethyl]-3,4-dihydro-1H-quinolin-2-one

6-[2-[1-aminopropan-2-yl(methyl)amino]ethyl]-3,4-dihydro-1H-quinolin-2-one (PubChem CID 117040127) has the molecular formula C15H23N3O and a molecular weight of 261.37 g/mol. Its IUPAC name is 6-[2-[1-aminopropan-2-yl(methyl)amino]ethyl]-3,4-dihydro-1H-quinolin-2-one.

Molecular Properties

Compound Name6-[2-[1-aminopropan-2-yl(methyl)amino]ethyl]-3,4-dihydro-1H-quinolin-2-one
PubChem CID117040127
Molecular FormulaC15H23N3O
Molecular Weight261.37 g/mol
Exact Mass261.18
IUPAC Name6-[2-[1-aminopropan-2-yl(methyl)amino]ethyl]-3,4-dihydro-1H-quinolin-2-one
SMILESCC(CN)N(C)CCc1ccc2c(c1)CCC(=O)N2
InChIInChI=1S/C15H23N3O/c1-11(10-16)18(2)8-7-12-3-5-14-13(9-12)4-6-15(19)17-14/h3,5,9,11H,4,6-8,10,16H2,1-2H3,(H,17,19)
InChIKeyXIDSIOWOIVESGN-UHFFFAOYSA-N
XLogP1.39
TPSA58.36 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500261.37
LogP ≤ 51.39
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

Analyze 6-[2-[1-aminopropan-2-yl(methyl)amino]ethyl]-3,4-dihydro-1H-quinolin-2-one with MolForge

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Related Compounds

6-[[1-aminopropan-2-yl(methyl)amino]methyl]-3,4-dihydro-1H-quinolin-2-one
CID 117039998
5-[2-[4-aminobutan-2-yl(methyl)amino]ethyl]-1,3-dihydroindol-2-one
CID 117040458
methyl-[2-(2-oxo-3,4-dihydro-1H-quinolin-6-yl)ethyl]carbamic acid
CID 115171257
6-(3-aminopentyl)-3,4-dihydro-1H-quinolin-2-one
CID 82475336
2-hydroxy-N-methyl-N-[2-(2-oxo-3,4-dihydro-1H-quinolin-6-yl)ethyl]acetamide
CID 115140170
6-[[4-aminobutyl(methyl)amino]methyl]-3,4-dihydro-1H-quinolin-2-one
CID 115201298
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
7-(2-aminoethyl)-1,3,4,5-tetrahydro-1-benzazepin-2-one
CID 82190756
6-[(1-amino-3-methylbutan-2-yl)-methylamino]-3,4-dihydro-1H-quinolin-2-one
CID 115138025

Frequently Asked Questions

What is the IUPAC name of 6-[2-[1-aminopropan-2-yl(methyl)amino]ethyl]-3,4-dihydro-1H-quinolin-2-one?
The IUPAC name of 6-[2-[1-aminopropan-2-yl(methyl)amino]ethyl]-3,4-dihydro-1H-quinolin-2-one (CID 117040127) is 6-[2-[1-aminopropan-2-yl(methyl)amino]ethyl]-3,4-dihydro-1H-quinolin-2-one.
What is the SMILES notation for 6-[2-[1-aminopropan-2-yl(methyl)amino]ethyl]-3,4-dihydro-1H-quinolin-2-one?
The canonical SMILES for 6-[2-[1-aminopropan-2-yl(methyl)amino]ethyl]-3,4-dihydro-1H-quinolin-2-one is CC(CN)N(C)CCc1ccc2c(c1)CCC(=O)N2.
What is the InChIKey of 6-[2-[1-aminopropan-2-yl(methyl)amino]ethyl]-3,4-dihydro-1H-quinolin-2-one?
The InChIKey is XIDSIOWOIVESGN-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H23N3O/c1-11(10-16)18(2)8-7-12-3-5-14-13(9-12)4-6-15(19)17-14/h3,5,9,11H,4,6-8,10,16H2,1-2H3,(H,17,19).
What are the key properties of 6-[2-[1-aminopropan-2-yl(methyl)amino]ethyl]-3,4-dihydro-1H-quinolin-2-one?
6-[2-[1-aminopropan-2-yl(methyl)amino]ethyl]-3,4-dihydro-1H-quinolin-2-one has a molecular weight of 261.37 g/mol, XLogP of 1.39, 5 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 6-[2-[1-aminopropan-2-yl(methyl)amino]ethyl]-3,4-dihydro-1H-quinolin-2-one is sourced from PubChem (CID 117040127), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).