3-hydroxy-1H-1,7-naphthyridin-2-one;hydrobromide

C8H7BrN2O2 — CID 135937902

IUPAC3-hydroxy-1H-1,7-naphthyridin-2-one;hydrobromide
SMILESBr.O=c1[nH]c2cnccc2cc1O
InChIInChI=1S/C8H6N2O2.BrH/c11-7-3-5-1-2-9-4-6(5)10-8(7)12;/h1-4,11H,(H,10,12);1H
InChIKeyXOXGUZASZBYWFL-UHFFFAOYSA-N
MW243.06 g/mol
LogP1.21
Rot. Bonds

About 3-hydroxy-1H-1,7-naphthyridin-2-one;hydrobromide

3-hydroxy-1H-1,7-naphthyridin-2-one;hydrobromide (PubChem CID 135937902) has the molecular formula C8H7BrN2O2 and a molecular weight of 243.06 g/mol. Its IUPAC name is 3-hydroxy-1H-1,7-naphthyridin-2-one;hydrobromide.

Molecular Properties

Compound Name3-hydroxy-1H-1,7-naphthyridin-2-one;hydrobromide
PubChem CID135937902
Molecular FormulaC8H7BrN2O2
Molecular Weight243.06 g/mol
Exact Mass241.97
IUPAC Name3-hydroxy-1H-1,7-naphthyridin-2-one;hydrobromide
SMILESBr.O=c1[nH]c2cnccc2cc1O
InChIInChI=1S/C8H6N2O2.BrH/c11-7-3-5-1-2-9-4-6(5)10-8(7)12;/h1-4,11H,(H,10,12);1H
InChIKeyXOXGUZASZBYWFL-UHFFFAOYSA-N
XLogP1.21
TPSA65.98 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500243.06
LogP ≤ 51.21
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 3-hydroxy-1H-1,7-naphthyridin-2-one;hydrobromide?
The IUPAC name of 3-hydroxy-1H-1,7-naphthyridin-2-one;hydrobromide (CID 135937902) is 3-hydroxy-1H-1,7-naphthyridin-2-one;hydrobromide.
What is the SMILES notation for 3-hydroxy-1H-1,7-naphthyridin-2-one;hydrobromide?
The canonical SMILES for 3-hydroxy-1H-1,7-naphthyridin-2-one;hydrobromide is Br.O=c1[nH]c2cnccc2cc1O.
What is the InChIKey of 3-hydroxy-1H-1,7-naphthyridin-2-one;hydrobromide?
The InChIKey is XOXGUZASZBYWFL-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H6N2O2.BrH/c11-7-3-5-1-2-9-4-6(5)10-8(7)12;/h1-4,11H,(H,10,12);1H.
What are the key properties of 3-hydroxy-1H-1,7-naphthyridin-2-one;hydrobromide?
3-hydroxy-1H-1,7-naphthyridin-2-one;hydrobromide has a molecular weight of 243.06 g/mol, XLogP of 1.21, 0 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 3-hydroxy-1H-1,7-naphthyridin-2-one;hydrobromide is sourced from PubChem (CID 135937902), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).