5,6,7,8-tetrahydro-1,5-naphthyridin-2-amine

C8H11N3 — CID 130119178

IUPAC5,6,7,8-tetrahydro-1,5-naphthyridin-2-amine
SMILESNc1ccc2c(n1)CCCN2
InChIInChI=1S/C8H11N3/c9-8-4-3-6-7(11-8)2-1-5-10-6/h3-4,10H,1-2,5H2,(H2,9,11)
InChIKeyCMEXATFKZQGGHY-UHFFFAOYSA-N
MW149.20 g/mol
LogP1.02
Rot. Bonds

About 5,6,7,8-tetrahydro-1,5-naphthyridin-2-amine

5,6,7,8-tetrahydro-1,5-naphthyridin-2-amine (PubChem CID 130119178) has the molecular formula C8H11N3 and a molecular weight of 149.20 g/mol. Its IUPAC name is 5,6,7,8-tetrahydro-1,5-naphthyridin-2-amine.

Molecular Properties

Compound Name5,6,7,8-tetrahydro-1,5-naphthyridin-2-amine
PubChem CID130119178
Molecular FormulaC8H11N3
Molecular Weight149.20 g/mol
Exact Mass149.10
IUPAC Name5,6,7,8-tetrahydro-1,5-naphthyridin-2-amine
SMILESNc1ccc2c(n1)CCCN2
InChIInChI=1S/C8H11N3/c9-8-4-3-6-7(11-8)2-1-5-10-6/h3-4,10H,1-2,5H2,(H2,9,11)
InChIKeyCMEXATFKZQGGHY-UHFFFAOYSA-N
XLogP1.02
TPSA50.94 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500149.20
LogP ≤ 51.02
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 5,6,7,8-tetrahydro-1,5-naphthyridin-2-amine?
The IUPAC name of 5,6,7,8-tetrahydro-1,5-naphthyridin-2-amine (CID 130119178) is 5,6,7,8-tetrahydro-1,5-naphthyridin-2-amine.
What is the SMILES notation for 5,6,7,8-tetrahydro-1,5-naphthyridin-2-amine?
The canonical SMILES for 5,6,7,8-tetrahydro-1,5-naphthyridin-2-amine is Nc1ccc2c(n1)CCCN2.
What is the InChIKey of 5,6,7,8-tetrahydro-1,5-naphthyridin-2-amine?
The InChIKey is CMEXATFKZQGGHY-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H11N3/c9-8-4-3-6-7(11-8)2-1-5-10-6/h3-4,10H,1-2,5H2,(H2,9,11).
What are the key properties of 5,6,7,8-tetrahydro-1,5-naphthyridin-2-amine?
5,6,7,8-tetrahydro-1,5-naphthyridin-2-amine has a molecular weight of 149.20 g/mol, XLogP of 1.02, 0 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 5,6,7,8-tetrahydro-1,5-naphthyridin-2-amine is sourced from PubChem (CID 130119178), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).