6-[1-(methylamino)pentyl]-3,4-dihydro-1H-quinolin-2-one

C15H22N2O — CID 43483892

IUPAC6-[1-(methylamino)pentyl]-3,4-dihydro-1H-quinolin-2-one
SMILESCCCCC(NC)c1ccc2c(c1)CCC(=O)N2
InChIInChI=1S/C15H22N2O/c1-3-4-5-13(16-2)11-6-8-14-12(10-11)7-9-15(18)17-14/h6,8,10,13,16H,3-5,7,9H2,1-2H3,(H,17,18)
InChIKeyYBHBVMYGEGEUNY-UHFFFAOYSA-N
MW246.35 g/mol
LogP3.02
Rot. Bonds5

About 6-[1-(methylamino)pentyl]-3,4-dihydro-1H-quinolin-2-one

6-[1-(methylamino)pentyl]-3,4-dihydro-1H-quinolin-2-one (PubChem CID 43483892) has the molecular formula C15H22N2O and a molecular weight of 246.35 g/mol. Its IUPAC name is 6-[1-(methylamino)pentyl]-3,4-dihydro-1H-quinolin-2-one.

Molecular Properties

Compound Name6-[1-(methylamino)pentyl]-3,4-dihydro-1H-quinolin-2-one
PubChem CID43483892
Molecular FormulaC15H22N2O
Molecular Weight246.35 g/mol
Exact Mass246.17
IUPAC Name6-[1-(methylamino)pentyl]-3,4-dihydro-1H-quinolin-2-one
SMILESCCCCC(NC)c1ccc2c(c1)CCC(=O)N2
InChIInChI=1S/C15H22N2O/c1-3-4-5-13(16-2)11-6-8-14-12(10-11)7-9-15(18)17-14/h6,8,10,13,16H,3-5,7,9H2,1-2H3,(H,17,18)
InChIKeyYBHBVMYGEGEUNY-UHFFFAOYSA-N
XLogP3.02
TPSA41.13 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds5
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500246.35
LogP ≤ 53.02
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Related Compounds

7-[1-(methylamino)heptyl]-1,3,4,5-tetrahydro-1-benzazepin-2-one
CID 114752371
6-[1-(methylamino)-3-sulfanylpropyl]-3,4-dihydro-1H-quinolin-2-one
CID 116831398
6-[1-(propylamino)hexyl]-3,4-dihydro-1H-quinolin-2-one
CID 43496187
6-[1-(ethylamino)butyl]-3,4-dihydro-1H-quinolin-2-one
CID 43490895
6-[2-cyclobutyl-1-(methylamino)ethyl]-3,4-dihydro-1H-quinolin-2-one
CID 103162813
5-[4-hydroxy-1-(methylamino)butyl]-1,3-dihydroindol-2-one
CID 116952949
5-[4-amino-1-(methylamino)butyl]-1,3-dihydroindol-2-one
CID 116949295
7-(1-hydroxypentyl)-1,3,4,5-tetrahydro-1-benzazepin-2-one
CID 61082820
6-(1-hydroxypropyl)-3,4-dihydro-1H-quinolin-2-one
CID 19854697
5-[2-ethyl-1-(methylamino)hexyl]-1,3-dihydroindol-2-one
CID 43484784
6-(1-imidazol-1-ylpentyl)-3,4-dihydro-1H-quinolin-2-one
CID 19854657
6-(1-hydroxybutan-2-yl)-3,4-dihydro-1H-quinolin-2-one
CID 116964107

Frequently Asked Questions

What is the IUPAC name of 6-[1-(methylamino)pentyl]-3,4-dihydro-1H-quinolin-2-one?
The IUPAC name of 6-[1-(methylamino)pentyl]-3,4-dihydro-1H-quinolin-2-one (CID 43483892) is 6-[1-(methylamino)pentyl]-3,4-dihydro-1H-quinolin-2-one.
What is the SMILES notation for 6-[1-(methylamino)pentyl]-3,4-dihydro-1H-quinolin-2-one?
The canonical SMILES for 6-[1-(methylamino)pentyl]-3,4-dihydro-1H-quinolin-2-one is CCCCC(NC)c1ccc2c(c1)CCC(=O)N2.
What is the InChIKey of 6-[1-(methylamino)pentyl]-3,4-dihydro-1H-quinolin-2-one?
The InChIKey is YBHBVMYGEGEUNY-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H22N2O/c1-3-4-5-13(16-2)11-6-8-14-12(10-11)7-9-15(18)17-14/h6,8,10,13,16H,3-5,7,9H2,1-2H3,(H,17,18).
What are the key properties of 6-[1-(methylamino)pentyl]-3,4-dihydro-1H-quinolin-2-one?
6-[1-(methylamino)pentyl]-3,4-dihydro-1H-quinolin-2-one has a molecular weight of 246.35 g/mol, XLogP of 3.02, 5 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 6-[1-(methylamino)pentyl]-3,4-dihydro-1H-quinolin-2-one is sourced from PubChem (CID 43483892), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).