ethane;7-methyl-3,4-dihydro-1H-1,8-naphthyridin-2-one

C11H16N2O — CID 143189329

IUPACethane;7-methyl-3,4-dihydro-1H-1,8-naphthyridin-2-one
SMILESCC.Cc1ccc2c(n1)NC(=O)CC2
InChIInChI=1S/C9H10N2O.C2H6/c1-6-2-3-7-4-5-8(12)11-9(7)10-6;1-2/h2-3H,4-5H2,1H3,(H,10,11,12);1-2H3
InChIKeyGGCCIZYXCSHWFX-UHFFFAOYSA-N
MW192.26 g/mol
LogP2.30
Rot. Bonds

About ethane;7-methyl-3,4-dihydro-1H-1,8-naphthyridin-2-one

ethane;7-methyl-3,4-dihydro-1H-1,8-naphthyridin-2-one (PubChem CID 143189329) has the molecular formula C11H16N2O and a molecular weight of 192.26 g/mol. Its IUPAC name is ethane;7-methyl-3,4-dihydro-1H-1,8-naphthyridin-2-one.

Molecular Properties

Compound Nameethane;7-methyl-3,4-dihydro-1H-1,8-naphthyridin-2-one
PubChem CID143189329
Molecular FormulaC11H16N2O
Molecular Weight192.26 g/mol
Exact Mass192.13
IUPAC Nameethane;7-methyl-3,4-dihydro-1H-1,8-naphthyridin-2-one
SMILESCC.Cc1ccc2c(n1)NC(=O)CC2
InChIInChI=1S/C9H10N2O.C2H6/c1-6-2-3-7-4-5-8(12)11-9(7)10-6;1-2/h2-3H,4-5H2,1H3,(H,10,11,12);1-2H3
InChIKeyGGCCIZYXCSHWFX-UHFFFAOYSA-N
XLogP2.30
TPSA41.99 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500192.26
LogP ≤ 52.30
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

methyl 7-oxo-6,8-dihydro-5H-1,8-naphthyridine-2-carboxylate
CID 69398457
2,7-dimethyl-1,2,3,4-tetrahydro-1,8-naphthyridine;ethane
CID 176962199
ethane;6-methyl-3,4-dihydro-1H-1,8-naphthyridin-2-one
CID 143766696
6-methyl-3,4-dihydro-1H-1,8-naphthyridin-2-one
CID 20752822
4-[(7-oxo-6,8-dihydro-5H-1,8-naphthyridin-2-yl)oxy]pentanal
CID 21073378
4-methyl-4-[(7-oxo-6,8-dihydro-5H-1,8-naphthyridin-2-yl)oxy]pentanal
CID 21073408
1,7-dimethyl-3,4-dihydro-1,8-naphthyridin-2-one;ethane
CID 162737758
2-methyl-7,8-dihydro-5H-1,7-naphthyridin-6-one
CID 130250553
3,4-dihydro-1H-quinolin-2-one;ethane
CID 90913605
1-hydroxy-N-(6-methyl-1,5-naphthyridin-4-yl)-4-[(7-oxo-6,8-dihydro-5H-1,8-naphthyridin-2-yl)methylamino]cyclohexane-1-carboxamide
CID 71146562
7-[4-(4-phenylpiperazin-1-yl)butoxy]-3,4-dihydro-1H-1,8-naphthyridin-2-one
CID 21073818
2,6-dimethyl-2,3-dihydro-1H-pyrrolo[2,3-b]pyridine
CID 58047118

Frequently Asked Questions

What is the IUPAC name of ethane;7-methyl-3,4-dihydro-1H-1,8-naphthyridin-2-one?
The IUPAC name of ethane;7-methyl-3,4-dihydro-1H-1,8-naphthyridin-2-one (CID 143189329) is ethane;7-methyl-3,4-dihydro-1H-1,8-naphthyridin-2-one.
What is the SMILES notation for ethane;7-methyl-3,4-dihydro-1H-1,8-naphthyridin-2-one?
The canonical SMILES for ethane;7-methyl-3,4-dihydro-1H-1,8-naphthyridin-2-one is CC.Cc1ccc2c(n1)NC(=O)CC2.
What is the InChIKey of ethane;7-methyl-3,4-dihydro-1H-1,8-naphthyridin-2-one?
The InChIKey is GGCCIZYXCSHWFX-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H10N2O.C2H6/c1-6-2-3-7-4-5-8(12)11-9(7)10-6;1-2/h2-3H,4-5H2,1H3,(H,10,11,12);1-2H3.
What are the key properties of ethane;7-methyl-3,4-dihydro-1H-1,8-naphthyridin-2-one?
ethane;7-methyl-3,4-dihydro-1H-1,8-naphthyridin-2-one has a molecular weight of 192.26 g/mol, XLogP of 2.30, 0 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for ethane;7-methyl-3,4-dihydro-1H-1,8-naphthyridin-2-one is sourced from PubChem (CID 143189329), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).