4a,5-dihydro-1,8-naphthyridin-3-amine

C8H9N3 — CID 146227147

IUPAC4a,5-dihydro-1,8-naphthyridin-3-amine
SMILESNC1=CC2CC=CN=C2N=C1
InChIInChI=1S/C8H9N3/c9-7-4-6-2-1-3-10-8(6)11-5-7/h1,3-6H,2,9H2
InChIKeyVZPZACGVVNFOBQ-UHFFFAOYSA-N
MW147.18 g/mol
LogP0.85
Rot. Bonds

About 4a,5-dihydro-1,8-naphthyridin-3-amine

4a,5-dihydro-1,8-naphthyridin-3-amine (PubChem CID 146227147) has the molecular formula C8H9N3 and a molecular weight of 147.18 g/mol. Its IUPAC name is 4a,5-dihydro-1,8-naphthyridin-3-amine.

Molecular Properties

Compound Name4a,5-dihydro-1,8-naphthyridin-3-amine
PubChem CID146227147
Molecular FormulaC8H9N3
Molecular Weight147.18 g/mol
Exact Mass147.08
IUPAC Name4a,5-dihydro-1,8-naphthyridin-3-amine
SMILESNC1=CC2CC=CN=C2N=C1
InChIInChI=1S/C8H9N3/c9-7-4-6-2-1-3-10-8(6)11-5-7/h1,3-6H,2,9H2
InChIKeyVZPZACGVVNFOBQ-UHFFFAOYSA-N
XLogP0.85
TPSA50.74 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500147.18
LogP ≤ 50.85
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 4a,5-dihydro-1,8-naphthyridin-3-amine?
The IUPAC name of 4a,5-dihydro-1,8-naphthyridin-3-amine (CID 146227147) is 4a,5-dihydro-1,8-naphthyridin-3-amine.
What is the SMILES notation for 4a,5-dihydro-1,8-naphthyridin-3-amine?
The canonical SMILES for 4a,5-dihydro-1,8-naphthyridin-3-amine is NC1=CC2CC=CN=C2N=C1.
What is the InChIKey of 4a,5-dihydro-1,8-naphthyridin-3-amine?
The InChIKey is VZPZACGVVNFOBQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H9N3/c9-7-4-6-2-1-3-10-8(6)11-5-7/h1,3-6H,2,9H2.
What are the key properties of 4a,5-dihydro-1,8-naphthyridin-3-amine?
4a,5-dihydro-1,8-naphthyridin-3-amine has a molecular weight of 147.18 g/mol, XLogP of 0.85, 0 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 4a,5-dihydro-1,8-naphthyridin-3-amine is sourced from PubChem (CID 146227147), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).