2,5-dimethyl-2,7-naphthyridin-3-one;ethane

C12H16N2O — CID 167522975

IUPAC2,5-dimethyl-2,7-naphthyridin-3-one;ethane
SMILESCC.Cc1cncc2cn(C)c(=O)cc12
InChIInChI=1S/C10H10N2O.C2H6/c1-7-4-11-5-8-6-12(2)10(13)3-9(7)8;1-2/h3-6H,1-2H3;1-2H3
InChIKeyYKSYBHHYUJTLEE-UHFFFAOYSA-N
MW204.27 g/mol
LogP2.27
Rot. Bonds

About 2,5-dimethyl-2,7-naphthyridin-3-one;ethane

2,5-dimethyl-2,7-naphthyridin-3-one;ethane (PubChem CID 167522975) has the molecular formula C12H16N2O and a molecular weight of 204.27 g/mol. Its IUPAC name is 2,5-dimethyl-2,7-naphthyridin-3-one;ethane.

Molecular Properties

Compound Name2,5-dimethyl-2,7-naphthyridin-3-one;ethane
PubChem CID167522975
Molecular FormulaC12H16N2O
Molecular Weight204.27 g/mol
Exact Mass204.13
IUPAC Name2,5-dimethyl-2,7-naphthyridin-3-one;ethane
SMILESCC.Cc1cncc2cn(C)c(=O)cc12
InChIInChI=1S/C10H10N2O.C2H6/c1-7-4-11-5-8-6-12(2)10(13)3-9(7)8;1-2/h3-6H,1-2H3;1-2H3
InChIKeyYKSYBHHYUJTLEE-UHFFFAOYSA-N
XLogP2.27
TPSA34.89 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500204.27
LogP ≤ 52.27
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

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Related Compounds

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
5-(1-amino-3-methyliminoprop-1-en-2-yl)-4-methyl-1H-pyridin-2-one
CID 163477509
4-Ethyl-7-methyl-1,7-naphthyridin-6-one
CID 167049338
Ethane;4-ethynyl-2,5-dimethyl-2,7-naphthyridin-3-one
CID 167521297
Ethane;2-methyl-2,7-naphthyridin-3-one
CID 167522446
Ethane;2-methyl-2,7-naphthyridin-3-one
CID 167523014

Frequently Asked Questions

What is the IUPAC name of 2,5-dimethyl-2,7-naphthyridin-3-one;ethane?
The IUPAC name of 2,5-dimethyl-2,7-naphthyridin-3-one;ethane (CID 167522975) is 2,5-dimethyl-2,7-naphthyridin-3-one;ethane.
What is the SMILES notation for 2,5-dimethyl-2,7-naphthyridin-3-one;ethane?
The canonical SMILES for 2,5-dimethyl-2,7-naphthyridin-3-one;ethane is CC.Cc1cncc2cn(C)c(=O)cc12.
What is the InChIKey of 2,5-dimethyl-2,7-naphthyridin-3-one;ethane?
The InChIKey is YKSYBHHYUJTLEE-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H10N2O.C2H6/c1-7-4-11-5-8-6-12(2)10(13)3-9(7)8;1-2/h3-6H,1-2H3;1-2H3.
What are the key properties of 2,5-dimethyl-2,7-naphthyridin-3-one;ethane?
2,5-dimethyl-2,7-naphthyridin-3-one;ethane has a molecular weight of 204.27 g/mol, XLogP of 2.27, 0 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2,5-dimethyl-2,7-naphthyridin-3-one;ethane is sourced from PubChem (CID 167522975), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).