2,4-dimethyl-7-pyridin-2-yl-7,8-dihydro-6H-quinolin-5-one

C16H16N2O — CID 18317434

IUPAC2,4-dimethyl-7-pyridin-2-yl-7,8-dihydro-6H-quinolin-5-one
SMILESCc1cc(C)c2c(n1)CC(c1ccccn1)CC2=O
InChIInChI=1S/C16H16N2O/c1-10-7-11(2)18-14-8-12(9-15(19)16(10)14)13-5-3-4-6-17-13/h3-7,12H,8-9H2,1-2H3
InChIKeyCWSVDXWAEQIOFY-UHFFFAOYSA-N
MW252.32 g/mol
LogP3.01
Rot. Bonds1

About 2,4-dimethyl-7-pyridin-2-yl-7,8-dihydro-6H-quinolin-5-one

2,4-dimethyl-7-pyridin-2-yl-7,8-dihydro-6H-quinolin-5-one (PubChem CID 18317434) has the molecular formula C16H16N2O and a molecular weight of 252.32 g/mol. Its IUPAC name is 2,4-dimethyl-7-pyridin-2-yl-7,8-dihydro-6H-quinolin-5-one.

Molecular Properties

Compound Name2,4-dimethyl-7-pyridin-2-yl-7,8-dihydro-6H-quinolin-5-one
PubChem CID18317434
Molecular FormulaC16H16N2O
Molecular Weight252.32 g/mol
Exact Mass252.13
IUPAC Name2,4-dimethyl-7-pyridin-2-yl-7,8-dihydro-6H-quinolin-5-one
SMILESCc1cc(C)c2c(n1)CC(c1ccccn1)CC2=O
InChIInChI=1S/C16H16N2O/c1-10-7-11(2)18-14-8-12(9-15(19)16(10)14)13-5-3-4-6-17-13/h3-7,12H,8-9H2,1-2H3
InChIKeyCWSVDXWAEQIOFY-UHFFFAOYSA-N
XLogP3.01
TPSA42.85 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds1
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500252.32
LogP ≤ 53.01
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 2,4-dimethyl-7-pyridin-2-yl-7,8-dihydro-6H-quinolin-5-one?
The IUPAC name of 2,4-dimethyl-7-pyridin-2-yl-7,8-dihydro-6H-quinolin-5-one (CID 18317434) is 2,4-dimethyl-7-pyridin-2-yl-7,8-dihydro-6H-quinolin-5-one.
What is the SMILES notation for 2,4-dimethyl-7-pyridin-2-yl-7,8-dihydro-6H-quinolin-5-one?
The canonical SMILES for 2,4-dimethyl-7-pyridin-2-yl-7,8-dihydro-6H-quinolin-5-one is Cc1cc(C)c2c(n1)CC(c1ccccn1)CC2=O.
What is the InChIKey of 2,4-dimethyl-7-pyridin-2-yl-7,8-dihydro-6H-quinolin-5-one?
The InChIKey is CWSVDXWAEQIOFY-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H16N2O/c1-10-7-11(2)18-14-8-12(9-15(19)16(10)14)13-5-3-4-6-17-13/h3-7,12H,8-9H2,1-2H3.
What are the key properties of 2,4-dimethyl-7-pyridin-2-yl-7,8-dihydro-6H-quinolin-5-one?
2,4-dimethyl-7-pyridin-2-yl-7,8-dihydro-6H-quinolin-5-one has a molecular weight of 252.32 g/mol, XLogP of 3.01, 1 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2,4-dimethyl-7-pyridin-2-yl-7,8-dihydro-6H-quinolin-5-one is sourced from PubChem (CID 18317434), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).