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

C11H14N2O — CID 167522446

IUPACethane;2-methyl-2,7-naphthyridin-3-one
SMILESCC.Cn1cc2cnccc2cc1=O
InChIInChI=1S/C9H8N2O.C2H6/c1-11-6-8-5-10-3-2-7(8)4-9(11)12;1-2/h2-6H,1H3;1-2H3
InChIKeyZVOFBNUJEKVBAN-UHFFFAOYSA-N
MW190.25 g/mol
LogP1.96
Rot. Bonds

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

ethane;2-methyl-2,7-naphthyridin-3-one (PubChem CID 167522446) has the molecular formula C11H14N2O and a molecular weight of 190.25 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 CID167522446
Molecular FormulaC11H14N2O
Molecular Weight190.25 g/mol
Exact Mass190.11
IUPAC Nameethane;2-methyl-2,7-naphthyridin-3-one
SMILESCC.Cn1cc2cnccc2cc1=O
InChIInChI=1S/C9H8N2O.C2H6/c1-11-6-8-5-10-3-2-7(8)4-9(11)12;1-2/h2-6H,1H3;1-2H3
InChIKeyZVOFBNUJEKVBAN-UHFFFAOYSA-N
XLogP1.96
TPSA34.89 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500190.25
LogP ≤ 51.96
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

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Related Compounds

2,6-Naphthyridin-3-ol
CID 57421637
Paraquat dipyridone
CID 85788581
2H-2,7-naphthyridin-3-one
CID 57421635
6,8-Dimethyl-1,6-naphthyridin-7-one
CID 59283979
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
Pyrido[4,3-c]azepin-3-one
CID 146240562
Pyrido[2,3-h][3]benzazepin-2-one
CID 154245543
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

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 167522446) 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.Cn1cc2cnccc2cc1=O.
What is the InChIKey of ethane;2-methyl-2,7-naphthyridin-3-one?
The InChIKey is ZVOFBNUJEKVBAN-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H8N2O.C2H6/c1-11-6-8-5-10-3-2-7(8)4-9(11)12;1-2/h2-6H,1H3;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 190.25 g/mol, XLogP of 1.96, 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 167522446), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).