2,8-dimethyl-6-phenyl-3,4-dihydro-2,7-naphthyridin-1-one

C16H16N2O — CID 11276805

IUPAC2,8-dimethyl-6-phenyl-3,4-dihydro-2,7-naphthyridin-1-one
SMILESCc1nc(-c2ccccc2)cc2c1C(=O)N(C)CC2
InChIInChI=1S/C16H16N2O/c1-11-15-13(8-9-18(2)16(15)19)10-14(17-11)12-6-4-3-5-7-12/h3-7,10H,8-9H2,1-2H3
InChIKeyOHDJFLAEDQXBQW-UHFFFAOYSA-N
MW252.32 g/mol
LogP2.69
Rot. Bonds1

About 2,8-dimethyl-6-phenyl-3,4-dihydro-2,7-naphthyridin-1-one

2,8-dimethyl-6-phenyl-3,4-dihydro-2,7-naphthyridin-1-one (PubChem CID 11276805) has the molecular formula C16H16N2O and a molecular weight of 252.32 g/mol. Its IUPAC name is 2,8-dimethyl-6-phenyl-3,4-dihydro-2,7-naphthyridin-1-one.

Molecular Properties

Compound Name2,8-dimethyl-6-phenyl-3,4-dihydro-2,7-naphthyridin-1-one
PubChem CID11276805
Molecular FormulaC16H16N2O
Molecular Weight252.32 g/mol
Exact Mass252.13
IUPAC Name2,8-dimethyl-6-phenyl-3,4-dihydro-2,7-naphthyridin-1-one
SMILESCc1nc(-c2ccccc2)cc2c1C(=O)N(C)CC2
InChIInChI=1S/C16H16N2O/c1-11-15-13(8-9-18(2)16(15)19)10-14(17-11)12-6-4-3-5-7-12/h3-7,10H,8-9H2,1-2H3
InChIKeyOHDJFLAEDQXBQW-UHFFFAOYSA-N
XLogP2.69
TPSA33.20 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds1
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500252.32
LogP ≤ 52.69
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 2,8-dimethyl-6-phenyl-3,4-dihydro-2,7-naphthyridin-1-one?
The IUPAC name of 2,8-dimethyl-6-phenyl-3,4-dihydro-2,7-naphthyridin-1-one (CID 11276805) is 2,8-dimethyl-6-phenyl-3,4-dihydro-2,7-naphthyridin-1-one.
What is the SMILES notation for 2,8-dimethyl-6-phenyl-3,4-dihydro-2,7-naphthyridin-1-one?
The canonical SMILES for 2,8-dimethyl-6-phenyl-3,4-dihydro-2,7-naphthyridin-1-one is Cc1nc(-c2ccccc2)cc2c1C(=O)N(C)CC2.
What is the InChIKey of 2,8-dimethyl-6-phenyl-3,4-dihydro-2,7-naphthyridin-1-one?
The InChIKey is OHDJFLAEDQXBQW-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H16N2O/c1-11-15-13(8-9-18(2)16(15)19)10-14(17-11)12-6-4-3-5-7-12/h3-7,10H,8-9H2,1-2H3.
What are the key properties of 2,8-dimethyl-6-phenyl-3,4-dihydro-2,7-naphthyridin-1-one?
2,8-dimethyl-6-phenyl-3,4-dihydro-2,7-naphthyridin-1-one has a molecular weight of 252.32 g/mol, XLogP of 2.69, 1 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2,8-dimethyl-6-phenyl-3,4-dihydro-2,7-naphthyridin-1-one is sourced from PubChem (CID 11276805), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).