2,10-dimethyl-4,5-dihydro-3H-benzo[b][1,7]naphthyridin-1-one

C14H16N2O — CID 20760294

IUPAC2,10-dimethyl-4,5-dihydro-3H-benzo[b][1,7]naphthyridin-1-one
SMILESCN1CCC2=C(C1=O)N(C)c1ccccc1C2
InChIInChI=1S/C14H16N2O/c1-15-8-7-11-9-10-5-3-4-6-12(10)16(2)13(11)14(15)17/h3-6H,7-9H2,1-2H3
InChIKeyIIDFCEQNRJRPPR-UHFFFAOYSA-N
MW228.30 g/mol
LogP1.80
Rot. Bonds

About 2,10-dimethyl-4,5-dihydro-3H-benzo[b][1,7]naphthyridin-1-one

2,10-dimethyl-4,5-dihydro-3H-benzo[b][1,7]naphthyridin-1-one (PubChem CID 20760294) has the molecular formula C14H16N2O and a molecular weight of 228.30 g/mol. Its IUPAC name is 2,10-dimethyl-4,5-dihydro-3H-benzo[b][1,7]naphthyridin-1-one.

Molecular Properties

Compound Name2,10-dimethyl-4,5-dihydro-3H-benzo[b][1,7]naphthyridin-1-one
PubChem CID20760294
Molecular FormulaC14H16N2O
Molecular Weight228.30 g/mol
Exact Mass228.13
IUPAC Name2,10-dimethyl-4,5-dihydro-3H-benzo[b][1,7]naphthyridin-1-one
SMILESCN1CCC2=C(C1=O)N(C)c1ccccc1C2
InChIInChI=1S/C14H16N2O/c1-15-8-7-11-9-10-5-3-4-6-12(10)16(2)13(11)14(15)17/h3-6H,7-9H2,1-2H3
InChIKeyIIDFCEQNRJRPPR-UHFFFAOYSA-N
XLogP1.80
TPSA23.55 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500228.30
LogP ≤ 51.80
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

Analyze 2,10-dimethyl-4,5-dihydro-3H-benzo[b][1,7]naphthyridin-1-one with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Frequently Asked Questions

What is the IUPAC name of 2,10-dimethyl-4,5-dihydro-3H-benzo[b][1,7]naphthyridin-1-one?
The IUPAC name of 2,10-dimethyl-4,5-dihydro-3H-benzo[b][1,7]naphthyridin-1-one (CID 20760294) is 2,10-dimethyl-4,5-dihydro-3H-benzo[b][1,7]naphthyridin-1-one.
What is the SMILES notation for 2,10-dimethyl-4,5-dihydro-3H-benzo[b][1,7]naphthyridin-1-one?
The canonical SMILES for 2,10-dimethyl-4,5-dihydro-3H-benzo[b][1,7]naphthyridin-1-one is CN1CCC2=C(C1=O)N(C)c1ccccc1C2.
What is the InChIKey of 2,10-dimethyl-4,5-dihydro-3H-benzo[b][1,7]naphthyridin-1-one?
The InChIKey is IIDFCEQNRJRPPR-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H16N2O/c1-15-8-7-11-9-10-5-3-4-6-12(10)16(2)13(11)14(15)17/h3-6H,7-9H2,1-2H3.
What are the key properties of 2,10-dimethyl-4,5-dihydro-3H-benzo[b][1,7]naphthyridin-1-one?
2,10-dimethyl-4,5-dihydro-3H-benzo[b][1,7]naphthyridin-1-one has a molecular weight of 228.30 g/mol, XLogP of 1.80, 0 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2,10-dimethyl-4,5-dihydro-3H-benzo[b][1,7]naphthyridin-1-one is sourced from PubChem (CID 20760294), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).