3,4,5,6-tetrahydro-1,7-naphthyridine

C8H10N2 — CID 173071922

IUPAC3,4,5,6-tetrahydro-1,7-naphthyridine
SMILESC1=NCCC2=C1N=CCC2
InChIInChI=1S/C8H10N2/c1-2-7-3-5-9-6-8(7)10-4-1/h4,6H,1-3,5H2
InChIKeyLJCJJIWTRISNJO-UHFFFAOYSA-N
MW134.18 g/mol
LogP1.58
Rot. Bonds

About 3,4,5,6-tetrahydro-1,7-naphthyridine

3,4,5,6-tetrahydro-1,7-naphthyridine (PubChem CID 173071922) has the molecular formula C8H10N2 and a molecular weight of 134.18 g/mol. Its IUPAC name is 3,4,5,6-tetrahydro-1,7-naphthyridine.

Molecular Properties

Compound Name3,4,5,6-tetrahydro-1,7-naphthyridine
PubChem CID173071922
Molecular FormulaC8H10N2
Molecular Weight134.18 g/mol
Exact Mass134.08
IUPAC Name3,4,5,6-tetrahydro-1,7-naphthyridine
SMILESC1=NCCC2=C1N=CCC2
InChIInChI=1S/C8H10N2/c1-2-7-3-5-9-6-8(7)10-4-1/h4,6H,1-3,5H2
InChIKeyLJCJJIWTRISNJO-UHFFFAOYSA-N
XLogP1.58
TPSA24.72 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds
Heavy Atoms10
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500134.18
LogP ≤ 51.58
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Related Compounds

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3,4,5,8-Tetrahydro-1,6-naphthyridine
CID 91015384
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CID 91121221
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CID 91430431
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1-Ethyl-3,4,7,8-tetrahydro-2,6-naphthyridine
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Frequently Asked Questions

What is the IUPAC name of 3,4,5,6-tetrahydro-1,7-naphthyridine?
The IUPAC name of 3,4,5,6-tetrahydro-1,7-naphthyridine (CID 173071922) is 3,4,5,6-tetrahydro-1,7-naphthyridine.
What is the SMILES notation for 3,4,5,6-tetrahydro-1,7-naphthyridine?
The canonical SMILES for 3,4,5,6-tetrahydro-1,7-naphthyridine is C1=NCCC2=C1N=CCC2.
What is the InChIKey of 3,4,5,6-tetrahydro-1,7-naphthyridine?
The InChIKey is LJCJJIWTRISNJO-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H10N2/c1-2-7-3-5-9-6-8(7)10-4-1/h4,6H,1-3,5H2.
What are the key properties of 3,4,5,6-tetrahydro-1,7-naphthyridine?
3,4,5,6-tetrahydro-1,7-naphthyridine has a molecular weight of 134.18 g/mol, XLogP of 1.58, 0 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 3,4,5,6-tetrahydro-1,7-naphthyridine is sourced from PubChem (CID 173071922), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).