1-(7,8-dihydro-5H-1,6-naphthyridin-6-yl)-2-methoxyethanone

C11H14N2O2 — CID 64592092

IUPAC1-(7,8-dihydro-5H-1,6-naphthyridin-6-yl)-2-methoxyethanone
SMILESCOCC(=O)N1CCc2ncccc2C1
InChIInChI=1S/C11H14N2O2/c1-15-8-11(14)13-6-4-10-9(7-13)3-2-5-12-10/h2-3,5H,4,6-8H2,1H3
InChIKeyJXFNCCPSWAYSJS-UHFFFAOYSA-N
MW206.25 g/mol
LogP0.61
Rot. Bonds2

About 1-(7,8-dihydro-5H-1,6-naphthyridin-6-yl)-2-methoxyethanone

1-(7,8-dihydro-5H-1,6-naphthyridin-6-yl)-2-methoxyethanone (PubChem CID 64592092) has the molecular formula C11H14N2O2 and a molecular weight of 206.25 g/mol. Its IUPAC name is 1-(7,8-dihydro-5H-1,6-naphthyridin-6-yl)-2-methoxyethanone.

Molecular Properties

Compound Name1-(7,8-dihydro-5H-1,6-naphthyridin-6-yl)-2-methoxyethanone
PubChem CID64592092
Molecular FormulaC11H14N2O2
Molecular Weight206.25 g/mol
Exact Mass206.11
IUPAC Name1-(7,8-dihydro-5H-1,6-naphthyridin-6-yl)-2-methoxyethanone
SMILESCOCC(=O)N1CCc2ncccc2C1
InChIInChI=1S/C11H14N2O2/c1-15-8-11(14)13-6-4-10-9(7-13)3-2-5-12-10/h2-3,5H,4,6-8H2,1H3
InChIKeyJXFNCCPSWAYSJS-UHFFFAOYSA-N
XLogP0.61
TPSA42.43 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500206.25
LogP ≤ 50.61
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

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Related Compounds

1-(7,8-dihydro-5H-1,6-naphthyridin-6-yl)propan-1-one
CID 64591824
1-[(3S)-3-(7,8-dihydro-5H-1,6-naphthyridine-6-carbonyl)piperidin-1-yl]-2-methoxyethanone
CID 97193702
2-(2-aminoethoxy)-1-(7,8-dihydro-5H-1,6-naphthyridin-6-yl)ethanone
CID 79472972
1-(7,8-dihydro-5H-1,6-naphthyridin-6-yl)-2-piperidin-4-yloxyethanone
CID 63877593
2-(tert-butylamino)-1-(7,8-dihydro-5H-1,6-naphthyridin-6-yl)ethanone
CID 79257456
1-(7,8-dihydro-5H-1,6-naphthyridin-6-yl)-4-(methylamino)butan-1-one
CID 60862591
7-amino-1-(7,8-dihydro-5H-1,6-naphthyridin-6-yl)heptan-1-one
CID 60862584
1-(7,8-dihydro-5H-1,6-naphthyridin-6-yl)-2-methylpropan-1-one
CID 64591291
N,N-dimethyl-7,8-dihydro-5H-1,6-naphthyridine-6-carboxamide
CID 175128670
1-(7,8-dihydro-5H-1,6-naphthyridin-6-yl)-3-hydroxy-3-methylhexan-1-one
CID 154873944
2-(1-aminocyclohexyl)-1-(7,8-dihydro-5H-1,6-naphthyridin-6-yl)ethanone
CID 64683261
3-chloro-1-(7,8-dihydro-5H-1,6-naphthyridin-6-yl)-2,2-dimethylpropan-1-one
CID 63680928

Frequently Asked Questions

What is the IUPAC name of 1-(7,8-dihydro-5H-1,6-naphthyridin-6-yl)-2-methoxyethanone?
The IUPAC name of 1-(7,8-dihydro-5H-1,6-naphthyridin-6-yl)-2-methoxyethanone (CID 64592092) is 1-(7,8-dihydro-5H-1,6-naphthyridin-6-yl)-2-methoxyethanone.
What is the SMILES notation for 1-(7,8-dihydro-5H-1,6-naphthyridin-6-yl)-2-methoxyethanone?
The canonical SMILES for 1-(7,8-dihydro-5H-1,6-naphthyridin-6-yl)-2-methoxyethanone is COCC(=O)N1CCc2ncccc2C1.
What is the InChIKey of 1-(7,8-dihydro-5H-1,6-naphthyridin-6-yl)-2-methoxyethanone?
The InChIKey is JXFNCCPSWAYSJS-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H14N2O2/c1-15-8-11(14)13-6-4-10-9(7-13)3-2-5-12-10/h2-3,5H,4,6-8H2,1H3.
What are the key properties of 1-(7,8-dihydro-5H-1,6-naphthyridin-6-yl)-2-methoxyethanone?
1-(7,8-dihydro-5H-1,6-naphthyridin-6-yl)-2-methoxyethanone has a molecular weight of 206.25 g/mol, XLogP of 0.61, 2 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(7,8-dihydro-5H-1,6-naphthyridin-6-yl)-2-methoxyethanone is sourced from PubChem (CID 64592092), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).