ethane;2-methyl-2,7-naphthyridin-3-one

C15H26N2O — CID 167523014

IUPACethane;2-methyl-2,7-naphthyridin-3-one
SMILESCC.CC.CC.Cn1cc2cnccc2cc1=O
InChIInChI=1S/C9H8N2O.3C2H6/c1-11-6-8-5-10-3-2-7(8)4-9(11)12;3*1-2/h2-6H,1H3;3*1-2H3
InChIKeyYIBLZBFSHYNCIP-UHFFFAOYSA-N
MW250.39 g/mol
LogP4.01
Rot. Bonds

About ethane;2-methyl-2,7-naphthyridin-3-one

ethane;2-methyl-2,7-naphthyridin-3-one (PubChem CID 167523014) has the molecular formula C15H26N2O and a molecular weight of 250.39 g/mol. Its IUPAC name is ethane;2-methyl-2,7-naphthyridin-3-one.

Molecular Properties

Compound Nameethane;2-methyl-2,7-naphthyridin-3-one
PubChem CID167523014
Molecular FormulaC15H26N2O
Molecular Weight250.39 g/mol
Exact Mass250.20
IUPAC Nameethane;2-methyl-2,7-naphthyridin-3-one
SMILESCC.CC.CC.Cn1cc2cnccc2cc1=O
InChIInChI=1S/C9H8N2O.3C2H6/c1-11-6-8-5-10-3-2-7(8)4-9(11)12;3*1-2/h2-6H,1H3;3*1-2H3
InChIKeyYIBLZBFSHYNCIP-UHFFFAOYSA-N
XLogP4.01
TPSA34.89 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500250.39
LogP ≤ 54.01
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

Analyze ethane;2-methyl-2,7-naphthyridin-3-one with MolForge

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

Launch Full Analysis

Related Compounds

2,6-Naphthyridin-3-ol
CID 57421637
2H-2,7-naphthyridin-3-one
CID 57421635
5,7-Dimethyl-1,7-naphthyridin-6-one
CID 59284093
3-(2,3-dihydropyridin-5-yl)-N,N-dimethylprop-2-enamide
CID 90845381
N,N-dimethyl-3-(3-methyl-2,3-dihydropyridin-5-yl)prop-2-enamide
CID 91432633
1-methyl-3-(methyliminomethyl)-4-[(Z)-prop-1-enyl]pyridin-2-one
CID 155041166
4,7-Dimethyl-1,7-naphthyridin-6-one;ethane
CID 163274686
4,7-Dimethyl-1,7-naphthyridin-6-one
CID 163274687
4,6-Dimethyl-1,6-naphthyridin-7-one;ethane
CID 163275462
4,6-Dimethyl-1,6-naphthyridin-7-one
CID 163275463
4-Ethyl-7-methyl-1,7-naphthyridin-6-one
CID 167049338
Ethane;4-ethynyl-2,5-dimethyl-2,7-naphthyridin-3-one
CID 167521297

Frequently Asked Questions

What is the IUPAC name of ethane;2-methyl-2,7-naphthyridin-3-one?
The IUPAC name of ethane;2-methyl-2,7-naphthyridin-3-one (CID 167523014) is ethane;2-methyl-2,7-naphthyridin-3-one.
What is the SMILES notation for ethane;2-methyl-2,7-naphthyridin-3-one?
The canonical SMILES for ethane;2-methyl-2,7-naphthyridin-3-one is CC.CC.CC.Cn1cc2cnccc2cc1=O.
What is the InChIKey of ethane;2-methyl-2,7-naphthyridin-3-one?
The InChIKey is YIBLZBFSHYNCIP-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H8N2O.3C2H6/c1-11-6-8-5-10-3-2-7(8)4-9(11)12;3*1-2/h2-6H,1H3;3*1-2H3.
What are the key properties of ethane;2-methyl-2,7-naphthyridin-3-one?
ethane;2-methyl-2,7-naphthyridin-3-one has a molecular weight of 250.39 g/mol, XLogP of 4.01, 0 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for ethane;2-methyl-2,7-naphthyridin-3-one is sourced from PubChem (CID 167523014), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).