10a-(4-methylphenyl)-1,2,3,10-tetrahydroimidazo[1,2-g][1,6]naphthyridin-5-one

C17H17N3O — CID 143649447

IUPAC10a-(4-methylphenyl)-1,2,3,10-tetrahydroimidazo[1,2-g][1,6]naphthyridin-5-one
SMILESCc1ccc(C23Cc4ncccc4C(=O)N2CCN3)cc1
InChIInChI=1S/C17H17N3O/c1-12-4-6-13(7-5-12)17-11-15-14(3-2-8-18-15)16(21)20(17)10-9-19-17/h2-8,19H,9-11H2,1H3
InChIKeyKUYXVSAAIRRZIH-UHFFFAOYSA-N
MW279.34 g/mol
LogP1.84
Rot. Bonds1

About 10a-(4-methylphenyl)-1,2,3,10-tetrahydroimidazo[1,2-g][1,6]naphthyridin-5-one

10a-(4-methylphenyl)-1,2,3,10-tetrahydroimidazo[1,2-g][1,6]naphthyridin-5-one (PubChem CID 143649447) has the molecular formula C17H17N3O and a molecular weight of 279.34 g/mol. Its IUPAC name is 10a-(4-methylphenyl)-1,2,3,10-tetrahydroimidazo[1,2-g][1,6]naphthyridin-5-one.

Molecular Properties

Compound Name10a-(4-methylphenyl)-1,2,3,10-tetrahydroimidazo[1,2-g][1,6]naphthyridin-5-one
PubChem CID143649447
Molecular FormulaC17H17N3O
Molecular Weight279.34 g/mol
Exact Mass279.14
IUPAC Name10a-(4-methylphenyl)-1,2,3,10-tetrahydroimidazo[1,2-g][1,6]naphthyridin-5-one
SMILESCc1ccc(C23Cc4ncccc4C(=O)N2CCN3)cc1
InChIInChI=1S/C17H17N3O/c1-12-4-6-13(7-5-12)17-11-15-14(3-2-8-18-15)16(21)20(17)10-9-19-17/h2-8,19H,9-11H2,1H3
InChIKeyKUYXVSAAIRRZIH-UHFFFAOYSA-N
XLogP1.84
TPSA45.23 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds1
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500279.34
LogP ≤ 51.84
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 10a-(4-methylphenyl)-1,2,3,10-tetrahydroimidazo[1,2-g][1,6]naphthyridin-5-one?
The IUPAC name of 10a-(4-methylphenyl)-1,2,3,10-tetrahydroimidazo[1,2-g][1,6]naphthyridin-5-one (CID 143649447) is 10a-(4-methylphenyl)-1,2,3,10-tetrahydroimidazo[1,2-g][1,6]naphthyridin-5-one.
What is the SMILES notation for 10a-(4-methylphenyl)-1,2,3,10-tetrahydroimidazo[1,2-g][1,6]naphthyridin-5-one?
The canonical SMILES for 10a-(4-methylphenyl)-1,2,3,10-tetrahydroimidazo[1,2-g][1,6]naphthyridin-5-one is Cc1ccc(C23Cc4ncccc4C(=O)N2CCN3)cc1.
What is the InChIKey of 10a-(4-methylphenyl)-1,2,3,10-tetrahydroimidazo[1,2-g][1,6]naphthyridin-5-one?
The InChIKey is KUYXVSAAIRRZIH-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H17N3O/c1-12-4-6-13(7-5-12)17-11-15-14(3-2-8-18-15)16(21)20(17)10-9-19-17/h2-8,19H,9-11H2,1H3.
What are the key properties of 10a-(4-methylphenyl)-1,2,3,10-tetrahydroimidazo[1,2-g][1,6]naphthyridin-5-one?
10a-(4-methylphenyl)-1,2,3,10-tetrahydroimidazo[1,2-g][1,6]naphthyridin-5-one has a molecular weight of 279.34 g/mol, XLogP of 1.84, 1 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 10a-(4-methylphenyl)-1,2,3,10-tetrahydroimidazo[1,2-g][1,6]naphthyridin-5-one is sourced from PubChem (CID 143649447), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).