(8-chloro-1,5-naphthyridin-2-yl)methanol

C9H7ClN2O — CID 174647269

IUPAC(8-chloro-1,5-naphthyridin-2-yl)methanol
SMILESOCc1ccc2nccc(Cl)c2n1
InChIInChI=1S/C9H7ClN2O/c10-7-3-4-11-8-2-1-6(5-13)12-9(7)8/h1-4,13H,5H2
InChIKeyVMWNJWMKKUWUJK-UHFFFAOYSA-N
MW194.62 g/mol
LogP1.78
Rot. Bonds1

About (8-chloro-1,5-naphthyridin-2-yl)methanol

(8-chloro-1,5-naphthyridin-2-yl)methanol (PubChem CID 174647269) has the molecular formula C9H7ClN2O and a molecular weight of 194.62 g/mol. Its IUPAC name is (8-chloro-1,5-naphthyridin-2-yl)methanol.

Molecular Properties

Compound Name(8-chloro-1,5-naphthyridin-2-yl)methanol
PubChem CID174647269
Molecular FormulaC9H7ClN2O
Molecular Weight194.62 g/mol
Exact Mass194.02
IUPAC Name(8-chloro-1,5-naphthyridin-2-yl)methanol
SMILESOCc1ccc2nccc(Cl)c2n1
InChIInChI=1S/C9H7ClN2O/c10-7-3-4-11-8-2-1-6(5-13)12-9(7)8/h1-4,13H,5H2
InChIKeyVMWNJWMKKUWUJK-UHFFFAOYSA-N
XLogP1.78
TPSA46.01 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds1
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500194.62
LogP ≤ 51.78
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of (8-chloro-1,5-naphthyridin-2-yl)methanol?
The IUPAC name of (8-chloro-1,5-naphthyridin-2-yl)methanol (CID 174647269) is (8-chloro-1,5-naphthyridin-2-yl)methanol.
What is the SMILES notation for (8-chloro-1,5-naphthyridin-2-yl)methanol?
The canonical SMILES for (8-chloro-1,5-naphthyridin-2-yl)methanol is OCc1ccc2nccc(Cl)c2n1.
What is the InChIKey of (8-chloro-1,5-naphthyridin-2-yl)methanol?
The InChIKey is VMWNJWMKKUWUJK-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H7ClN2O/c10-7-3-4-11-8-2-1-6(5-13)12-9(7)8/h1-4,13H,5H2.
What are the key properties of (8-chloro-1,5-naphthyridin-2-yl)methanol?
(8-chloro-1,5-naphthyridin-2-yl)methanol has a molecular weight of 194.62 g/mol, XLogP of 1.78, 1 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for (8-chloro-1,5-naphthyridin-2-yl)methanol is sourced from PubChem (CID 174647269), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).