(5-chlorothiophen-2-yl)-(6-methoxypyridazin-3-yl)methanol

C10H9ClN2O2S — CID 103373480

IUPAC(5-chlorothiophen-2-yl)-(6-methoxypyridazin-3-yl)methanol
SMILESCOc1ccc(C(O)c2ccc(Cl)s2)nn1
InChIInChI=1S/C10H9ClN2O2S/c1-15-9-5-2-6(12-13-9)10(14)7-3-4-8(11)16-7/h2-5,10,14H,1H3
InChIKeyFYVFYVQLAXHYLU-UHFFFAOYSA-N
MW256.71 g/mol
LogP2.28
Rot. Bonds3

About (5-chlorothiophen-2-yl)-(6-methoxypyridazin-3-yl)methanol

(5-chlorothiophen-2-yl)-(6-methoxypyridazin-3-yl)methanol (PubChem CID 103373480) has the molecular formula C10H9ClN2O2S and a molecular weight of 256.71 g/mol. Its IUPAC name is (5-chlorothiophen-2-yl)-(6-methoxypyridazin-3-yl)methanol.

Molecular Properties

Compound Name(5-chlorothiophen-2-yl)-(6-methoxypyridazin-3-yl)methanol
PubChem CID103373480
Molecular FormulaC10H9ClN2O2S
Molecular Weight256.71 g/mol
Exact Mass256.01
IUPAC Name(5-chlorothiophen-2-yl)-(6-methoxypyridazin-3-yl)methanol
SMILESCOc1ccc(C(O)c2ccc(Cl)s2)nn1
InChIInChI=1S/C10H9ClN2O2S/c1-15-9-5-2-6(12-13-9)10(14)7-3-4-8(11)16-7/h2-5,10,14H,1H3
InChIKeyFYVFYVQLAXHYLU-UHFFFAOYSA-N
XLogP2.28
TPSA55.24 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds3
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500256.71
LogP ≤ 52.28
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Frequently Asked Questions

What is the IUPAC name of (5-chlorothiophen-2-yl)-(6-methoxypyridazin-3-yl)methanol?
The IUPAC name of (5-chlorothiophen-2-yl)-(6-methoxypyridazin-3-yl)methanol (CID 103373480) is (5-chlorothiophen-2-yl)-(6-methoxypyridazin-3-yl)methanol.
What is the SMILES notation for (5-chlorothiophen-2-yl)-(6-methoxypyridazin-3-yl)methanol?
The canonical SMILES for (5-chlorothiophen-2-yl)-(6-methoxypyridazin-3-yl)methanol is COc1ccc(C(O)c2ccc(Cl)s2)nn1.
What is the InChIKey of (5-chlorothiophen-2-yl)-(6-methoxypyridazin-3-yl)methanol?
The InChIKey is FYVFYVQLAXHYLU-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H9ClN2O2S/c1-15-9-5-2-6(12-13-9)10(14)7-3-4-8(11)16-7/h2-5,10,14H,1H3.
What are the key properties of (5-chlorothiophen-2-yl)-(6-methoxypyridazin-3-yl)methanol?
(5-chlorothiophen-2-yl)-(6-methoxypyridazin-3-yl)methanol has a molecular weight of 256.71 g/mol, XLogP of 2.28, 3 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for (5-chlorothiophen-2-yl)-(6-methoxypyridazin-3-yl)methanol is sourced from PubChem (CID 103373480), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).