5-(4,8-dimethyl-3,4-dihydro-2H-quinoline-1-carbonyl)-2-methyl-1H-pyridin-4-one

C18H20N2O2 — CID 154765814

IUPAC5-(4,8-dimethyl-3,4-dihydro-2H-quinoline-1-carbonyl)-2-methyl-1H-pyridin-4-one
SMILESCc1cc(=O)c(C(=O)N2CCC(C)c3cccc(C)c32)c[nH]1
InChIInChI=1S/C18H20N2O2/c1-11-7-8-20(17-12(2)5-4-6-14(11)17)18(22)15-10-19-13(3)9-16(15)21/h4-6,9-11H,7-8H2,1-3H3,(H,19,21)
InChIKeyRPDGWFWBKYGFEU-UHFFFAOYSA-N
MW296.37 g/mol
LogP3.15
Rot. Bonds1

About 5-(4,8-dimethyl-3,4-dihydro-2H-quinoline-1-carbonyl)-2-methyl-1H-pyridin-4-one

5-(4,8-dimethyl-3,4-dihydro-2H-quinoline-1-carbonyl)-2-methyl-1H-pyridin-4-one (PubChem CID 154765814) has the molecular formula C18H20N2O2 and a molecular weight of 296.37 g/mol. Its IUPAC name is 5-(4,8-dimethyl-3,4-dihydro-2H-quinoline-1-carbonyl)-2-methyl-1H-pyridin-4-one.

Molecular Properties

Compound Name5-(4,8-dimethyl-3,4-dihydro-2H-quinoline-1-carbonyl)-2-methyl-1H-pyridin-4-one
PubChem CID154765814
Molecular FormulaC18H20N2O2
Molecular Weight296.37 g/mol
Exact Mass296.15
IUPAC Name5-(4,8-dimethyl-3,4-dihydro-2H-quinoline-1-carbonyl)-2-methyl-1H-pyridin-4-one
SMILESCc1cc(=O)c(C(=O)N2CCC(C)c3cccc(C)c32)c[nH]1
InChIInChI=1S/C18H20N2O2/c1-11-7-8-20(17-12(2)5-4-6-14(11)17)18(22)15-10-19-13(3)9-16(15)21/h4-6,9-11H,7-8H2,1-3H3,(H,19,21)
InChIKeyRPDGWFWBKYGFEU-UHFFFAOYSA-N
XLogP3.15
TPSA53.17 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds1
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500296.37
LogP ≤ 53.15
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 5-(4,8-dimethyl-3,4-dihydro-2H-quinoline-1-carbonyl)-2-methyl-1H-pyridin-4-one?
The IUPAC name of 5-(4,8-dimethyl-3,4-dihydro-2H-quinoline-1-carbonyl)-2-methyl-1H-pyridin-4-one (CID 154765814) is 5-(4,8-dimethyl-3,4-dihydro-2H-quinoline-1-carbonyl)-2-methyl-1H-pyridin-4-one.
What is the SMILES notation for 5-(4,8-dimethyl-3,4-dihydro-2H-quinoline-1-carbonyl)-2-methyl-1H-pyridin-4-one?
The canonical SMILES for 5-(4,8-dimethyl-3,4-dihydro-2H-quinoline-1-carbonyl)-2-methyl-1H-pyridin-4-one is Cc1cc(=O)c(C(=O)N2CCC(C)c3cccc(C)c32)c[nH]1.
What is the InChIKey of 5-(4,8-dimethyl-3,4-dihydro-2H-quinoline-1-carbonyl)-2-methyl-1H-pyridin-4-one?
The InChIKey is RPDGWFWBKYGFEU-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H20N2O2/c1-11-7-8-20(17-12(2)5-4-6-14(11)17)18(22)15-10-19-13(3)9-16(15)21/h4-6,9-11H,7-8H2,1-3H3,(H,19,21).
What are the key properties of 5-(4,8-dimethyl-3,4-dihydro-2H-quinoline-1-carbonyl)-2-methyl-1H-pyridin-4-one?
5-(4,8-dimethyl-3,4-dihydro-2H-quinoline-1-carbonyl)-2-methyl-1H-pyridin-4-one has a molecular weight of 296.37 g/mol, XLogP of 3.15, 1 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 5-(4,8-dimethyl-3,4-dihydro-2H-quinoline-1-carbonyl)-2-methyl-1H-pyridin-4-one is sourced from PubChem (CID 154765814), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).