6-(diethylaminomethyl)-5-hydroxy-8-methyl-3,4-dihydro-1H-quinolin-2-one

C15H22N2O2 — CID 15650362

IUPAC6-(diethylaminomethyl)-5-hydroxy-8-methyl-3,4-dihydro-1H-quinolin-2-one
SMILESCCN(CC)Cc1cc(C)c2c(c1O)CCC(=O)N2
InChIInChI=1S/C15H22N2O2/c1-4-17(5-2)9-11-8-10(3)14-12(15(11)19)6-7-13(18)16-14/h8,19H,4-7,9H2,1-3H3,(H,16,18)
InChIKeyUBFJMBHLMMNZJT-UHFFFAOYSA-N
MW262.35 g/mol
LogP2.43
Rot. Bonds4

About 6-(diethylaminomethyl)-5-hydroxy-8-methyl-3,4-dihydro-1H-quinolin-2-one

6-(diethylaminomethyl)-5-hydroxy-8-methyl-3,4-dihydro-1H-quinolin-2-one (PubChem CID 15650362) has the molecular formula C15H22N2O2 and a molecular weight of 262.35 g/mol. Its IUPAC name is 6-(diethylaminomethyl)-5-hydroxy-8-methyl-3,4-dihydro-1H-quinolin-2-one.

Molecular Properties

Compound Name6-(diethylaminomethyl)-5-hydroxy-8-methyl-3,4-dihydro-1H-quinolin-2-one
PubChem CID15650362
Molecular FormulaC15H22N2O2
Molecular Weight262.35 g/mol
Exact Mass262.17
IUPAC Name6-(diethylaminomethyl)-5-hydroxy-8-methyl-3,4-dihydro-1H-quinolin-2-one
SMILESCCN(CC)Cc1cc(C)c2c(c1O)CCC(=O)N2
InChIInChI=1S/C15H22N2O2/c1-4-17(5-2)9-11-8-10(3)14-12(15(11)19)6-7-13(18)16-14/h8,19H,4-7,9H2,1-3H3,(H,16,18)
InChIKeyUBFJMBHLMMNZJT-UHFFFAOYSA-N
XLogP2.43
TPSA52.57 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500262.35
LogP ≤ 52.43
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'mannich_A(296)', 'substructure': 'N/A'}

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Frequently Asked Questions

What is the IUPAC name of 6-(diethylaminomethyl)-5-hydroxy-8-methyl-3,4-dihydro-1H-quinolin-2-one?
The IUPAC name of 6-(diethylaminomethyl)-5-hydroxy-8-methyl-3,4-dihydro-1H-quinolin-2-one (CID 15650362) is 6-(diethylaminomethyl)-5-hydroxy-8-methyl-3,4-dihydro-1H-quinolin-2-one.
What is the SMILES notation for 6-(diethylaminomethyl)-5-hydroxy-8-methyl-3,4-dihydro-1H-quinolin-2-one?
The canonical SMILES for 6-(diethylaminomethyl)-5-hydroxy-8-methyl-3,4-dihydro-1H-quinolin-2-one is CCN(CC)Cc1cc(C)c2c(c1O)CCC(=O)N2.
What is the InChIKey of 6-(diethylaminomethyl)-5-hydroxy-8-methyl-3,4-dihydro-1H-quinolin-2-one?
The InChIKey is UBFJMBHLMMNZJT-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H22N2O2/c1-4-17(5-2)9-11-8-10(3)14-12(15(11)19)6-7-13(18)16-14/h8,19H,4-7,9H2,1-3H3,(H,16,18).
What are the key properties of 6-(diethylaminomethyl)-5-hydroxy-8-methyl-3,4-dihydro-1H-quinolin-2-one?
6-(diethylaminomethyl)-5-hydroxy-8-methyl-3,4-dihydro-1H-quinolin-2-one has a molecular weight of 262.35 g/mol, XLogP of 2.43, 4 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 6-(diethylaminomethyl)-5-hydroxy-8-methyl-3,4-dihydro-1H-quinolin-2-one is sourced from PubChem (CID 15650362), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).