7-amino-1H-1,8-naphthyridin-2-one

C8H7N3O — CID 5464536

IUPAC7-amino-1H-1,8-naphthyridin-2-one
SMILESNc1ccc2ccc(=O)[nH]c2n1
InChIInChI=1S/C8H7N3O/c9-6-3-1-5-2-4-7(12)11-8(5)10-6/h1-4H,(H3,9,10,11,12)
InChIKeyNSPQTGOJGZXAJM-UHFFFAOYSA-N
MW161.16 g/mol
LogP0.51
Rot. Bonds

About 7-amino-1H-1,8-naphthyridin-2-one

7-amino-1H-1,8-naphthyridin-2-one (PubChem CID 5464536) has the molecular formula C8H7N3O and a molecular weight of 161.16 g/mol. Its IUPAC name is 7-amino-1H-1,8-naphthyridin-2-one.

Molecular Properties

Compound Name7-amino-1H-1,8-naphthyridin-2-one
PubChem CID5464536
Molecular FormulaC8H7N3O
Molecular Weight161.16 g/mol
Exact Mass161.06
IUPAC Name7-amino-1H-1,8-naphthyridin-2-one
SMILESNc1ccc2ccc(=O)[nH]c2n1
InChIInChI=1S/C8H7N3O/c9-6-3-1-5-2-4-7(12)11-8(5)10-6/h1-4H,(H3,9,10,11,12)
InChIKeyNSPQTGOJGZXAJM-UHFFFAOYSA-N
XLogP0.51
TPSA71.77 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500161.16
LogP ≤ 50.51
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 7-amino-1H-1,8-naphthyridin-2-one?
The IUPAC name of 7-amino-1H-1,8-naphthyridin-2-one (CID 5464536) is 7-amino-1H-1,8-naphthyridin-2-one.
What is the SMILES notation for 7-amino-1H-1,8-naphthyridin-2-one?
The canonical SMILES for 7-amino-1H-1,8-naphthyridin-2-one is Nc1ccc2ccc(=O)[nH]c2n1.
What is the InChIKey of 7-amino-1H-1,8-naphthyridin-2-one?
The InChIKey is NSPQTGOJGZXAJM-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H7N3O/c9-6-3-1-5-2-4-7(12)11-8(5)10-6/h1-4H,(H3,9,10,11,12).
What are the key properties of 7-amino-1H-1,8-naphthyridin-2-one?
7-amino-1H-1,8-naphthyridin-2-one has a molecular weight of 161.16 g/mol, XLogP of 0.51, 0 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 7-amino-1H-1,8-naphthyridin-2-one is sourced from PubChem (CID 5464536), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).