3-methoxy-2,7-naphthyridine-4-carbonitrile

C10H7N3O — CID 84718895

IUPAC3-methoxy-2,7-naphthyridine-4-carbonitrile
SMILESCOc1ncc2cnccc2c1C#N
InChIInChI=1S/C10H7N3O/c1-14-10-9(4-11)8-2-3-12-5-7(8)6-13-10/h2-3,5-6H,1H3
InChIKeyFEGINBWRBGPVTK-UHFFFAOYSA-N
MW185.19 g/mol
LogP1.51
Rot. Bonds1

About 3-methoxy-2,7-naphthyridine-4-carbonitrile

3-methoxy-2,7-naphthyridine-4-carbonitrile (PubChem CID 84718895) has the molecular formula C10H7N3O and a molecular weight of 185.19 g/mol. Its IUPAC name is 3-methoxy-2,7-naphthyridine-4-carbonitrile.

Molecular Properties

Compound Name3-methoxy-2,7-naphthyridine-4-carbonitrile
PubChem CID84718895
Molecular FormulaC10H7N3O
Molecular Weight185.19 g/mol
Exact Mass185.06
IUPAC Name3-methoxy-2,7-naphthyridine-4-carbonitrile
SMILESCOc1ncc2cnccc2c1C#N
InChIInChI=1S/C10H7N3O/c1-14-10-9(4-11)8-2-3-12-5-7(8)6-13-10/h2-3,5-6H,1H3
InChIKeyFEGINBWRBGPVTK-UHFFFAOYSA-N
XLogP1.51
TPSA58.80 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds1
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500185.19
LogP ≤ 51.51
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

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Related Compounds

2-Methoxy-6-phenyl-4-pyridin-4-ylpyridine-3-carbonitrile
CID 154644621
1-Methoxyisoquinoline
CID 141052
2-Methoxypyridine-3-carbonitrile
CID 252099
5-[2-(6-Methoxy-2-pyridinyl)ethynyl]pyridine-3-carbonitrile
CID 70691264
2-Methoxy-5-pyridinecarbonitrile
CID 2736776
8-Bromo-5-methoxy-1,6-naphthyridine
CID 16093132
2-Methoxyisonicotinonitrile
CID 7204887
6-Methoxy-4-methylpyridine-3-carbonitrile
CID 10630664
2-(6-Methoxypyridin-3-YL)acetonitrile
CID 45079846
1,2,3,4-Tetrahydro-5-methoxy-2,6-naphthyridine
CID 72212330
5-Bromo-1-methoxy-2,7-naphthyridine
CID 137928487
2-Methoxy-5-methyl-1,6-naphthyridine
CID 10080864

Frequently Asked Questions

What is the IUPAC name of 3-methoxy-2,7-naphthyridine-4-carbonitrile?
The IUPAC name of 3-methoxy-2,7-naphthyridine-4-carbonitrile (CID 84718895) is 3-methoxy-2,7-naphthyridine-4-carbonitrile.
What is the SMILES notation for 3-methoxy-2,7-naphthyridine-4-carbonitrile?
The canonical SMILES for 3-methoxy-2,7-naphthyridine-4-carbonitrile is COc1ncc2cnccc2c1C#N.
What is the InChIKey of 3-methoxy-2,7-naphthyridine-4-carbonitrile?
The InChIKey is FEGINBWRBGPVTK-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H7N3O/c1-14-10-9(4-11)8-2-3-12-5-7(8)6-13-10/h2-3,5-6H,1H3.
What are the key properties of 3-methoxy-2,7-naphthyridine-4-carbonitrile?
3-methoxy-2,7-naphthyridine-4-carbonitrile has a molecular weight of 185.19 g/mol, XLogP of 1.51, 1 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 3-methoxy-2,7-naphthyridine-4-carbonitrile is sourced from PubChem (CID 84718895), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).