6-(5-methylpiperidin-2-yl)-3,4-dihydro-1H-quinolin-2-one

C15H20N2O — CID 164753190

IUPAC6-(5-methylpiperidin-2-yl)-3,4-dihydro-1H-quinolin-2-one
SMILESCC1CCC(c2ccc3c(c2)CCC(=O)N3)NC1
InChIInChI=1S/C15H20N2O/c1-10-2-5-13(16-9-10)11-3-6-14-12(8-11)4-7-15(18)17-14/h3,6,8,10,13,16H,2,4-5,7,9H2,1H3,(H,17,18)
InChIKeyASQBYMZROVJZEK-UHFFFAOYSA-N
MW244.34 g/mol
LogP2.63
Rot. Bonds1

About 6-(5-methylpiperidin-2-yl)-3,4-dihydro-1H-quinolin-2-one

6-(5-methylpiperidin-2-yl)-3,4-dihydro-1H-quinolin-2-one (PubChem CID 164753190) has the molecular formula C15H20N2O and a molecular weight of 244.34 g/mol. Its IUPAC name is 6-(5-methylpiperidin-2-yl)-3,4-dihydro-1H-quinolin-2-one.

Molecular Properties

Compound Name6-(5-methylpiperidin-2-yl)-3,4-dihydro-1H-quinolin-2-one
PubChem CID164753190
Molecular FormulaC15H20N2O
Molecular Weight244.34 g/mol
Exact Mass244.16
IUPAC Name6-(5-methylpiperidin-2-yl)-3,4-dihydro-1H-quinolin-2-one
SMILESCC1CCC(c2ccc3c(c2)CCC(=O)N3)NC1
InChIInChI=1S/C15H20N2O/c1-10-2-5-13(16-9-10)11-3-6-14-12(8-11)4-7-15(18)17-14/h3,6,8,10,13,16H,2,4-5,7,9H2,1H3,(H,17,18)
InChIKeyASQBYMZROVJZEK-UHFFFAOYSA-N
XLogP2.63
TPSA41.13 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds1
Heavy Atoms18
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500244.34
LogP ≤ 52.63
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 6-(5-methylpiperidin-2-yl)-3,4-dihydro-1H-quinolin-2-one?
The IUPAC name of 6-(5-methylpiperidin-2-yl)-3,4-dihydro-1H-quinolin-2-one (CID 164753190) is 6-(5-methylpiperidin-2-yl)-3,4-dihydro-1H-quinolin-2-one.
What is the SMILES notation for 6-(5-methylpiperidin-2-yl)-3,4-dihydro-1H-quinolin-2-one?
The canonical SMILES for 6-(5-methylpiperidin-2-yl)-3,4-dihydro-1H-quinolin-2-one is CC1CCC(c2ccc3c(c2)CCC(=O)N3)NC1.
What is the InChIKey of 6-(5-methylpiperidin-2-yl)-3,4-dihydro-1H-quinolin-2-one?
The InChIKey is ASQBYMZROVJZEK-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H20N2O/c1-10-2-5-13(16-9-10)11-3-6-14-12(8-11)4-7-15(18)17-14/h3,6,8,10,13,16H,2,4-5,7,9H2,1H3,(H,17,18).
What are the key properties of 6-(5-methylpiperidin-2-yl)-3,4-dihydro-1H-quinolin-2-one?
6-(5-methylpiperidin-2-yl)-3,4-dihydro-1H-quinolin-2-one has a molecular weight of 244.34 g/mol, XLogP of 2.63, 1 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 6-(5-methylpiperidin-2-yl)-3,4-dihydro-1H-quinolin-2-one is sourced from PubChem (CID 164753190), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).