[6-(2-ethylcyclohexyl)oxypyridazin-3-yl]methanol

C13H20N2O2 — CID 61257773

IUPAC[6-(2-ethylcyclohexyl)oxypyridazin-3-yl]methanol
SMILESCCC1CCCCC1Oc1ccc(CO)nn1
InChIInChI=1S/C13H20N2O2/c1-2-10-5-3-4-6-12(10)17-13-8-7-11(9-16)14-15-13/h7-8,10,12,16H,2-6,9H2,1H3
InChIKeyJTUMWOQUKTZROX-UHFFFAOYSA-N
MW236.31 g/mol
LogP2.32
Rot. Bonds4

About [6-(2-ethylcyclohexyl)oxypyridazin-3-yl]methanol

[6-(2-ethylcyclohexyl)oxypyridazin-3-yl]methanol (PubChem CID 61257773) has the molecular formula C13H20N2O2 and a molecular weight of 236.31 g/mol. Its IUPAC name is [6-(2-ethylcyclohexyl)oxypyridazin-3-yl]methanol.

Molecular Properties

Compound Name[6-(2-ethylcyclohexyl)oxypyridazin-3-yl]methanol
PubChem CID61257773
Molecular FormulaC13H20N2O2
Molecular Weight236.31 g/mol
Exact Mass236.15
IUPAC Name[6-(2-ethylcyclohexyl)oxypyridazin-3-yl]methanol
SMILESCCC1CCCCC1Oc1ccc(CO)nn1
InChIInChI=1S/C13H20N2O2/c1-2-10-5-3-4-6-12(10)17-13-8-7-11(9-16)14-15-13/h7-8,10,12,16H,2-6,9H2,1H3
InChIKeyJTUMWOQUKTZROX-UHFFFAOYSA-N
XLogP2.32
TPSA55.24 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500236.31
LogP ≤ 52.32
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

[3-(6-Methoxypyridazin-3-yl)phenyl]methanol
CID 53425314
(6-Methoxypyridazin-3-yl)methanol
CID 13227305
(6-(2-(2-(2-Methoxyethoxy)ethoxy)ethoxy)pyridazin-3-yl)methanol
CID 104564146
[6-(Propan-2-yloxy)pyridazin-3-yl]methanol hydrochloride
CID 137944356
(6-Methoxypyridazin-3-yl)-phenylmethanol
CID 10036246
(2S)-1-(5,6-dimethylpyridazin-3-yl)oxy-3-phenylmethoxypropan-2-ol
CID 97565739
(1R)-1-(3,5-dimethylphenyl)-2-(5,6-dimethylpyridazin-3-yl)oxyethanol
CID 124224820
3-(Cyclopentyloxy)-6-cyclopropylpyridazine
CID 126954342
3-[(1S)-1-cyclopropylethoxy]-5,6,7,8-tetrahydrocinnoline
CID 164636614
3-Butoxy-6-[2-[4-[2-fluoro-2-(4-propylcyclohexyl)ethyl]cyclohexyl]ethyl]pyridazine
CID 18605279
3-Butoxy-6-[2-fluoro-2-(4-propylcyclohexyl)ethyl]pyridazine
CID 18605323
3-Butoxy-6-[4-(3-fluoropropyl)cyclohexyl]pyridazine
CID 18611482

Frequently Asked Questions

What is the IUPAC name of [6-(2-ethylcyclohexyl)oxypyridazin-3-yl]methanol?
The IUPAC name of [6-(2-ethylcyclohexyl)oxypyridazin-3-yl]methanol (CID 61257773) is [6-(2-ethylcyclohexyl)oxypyridazin-3-yl]methanol.
What is the SMILES notation for [6-(2-ethylcyclohexyl)oxypyridazin-3-yl]methanol?
The canonical SMILES for [6-(2-ethylcyclohexyl)oxypyridazin-3-yl]methanol is CCC1CCCCC1Oc1ccc(CO)nn1.
What is the InChIKey of [6-(2-ethylcyclohexyl)oxypyridazin-3-yl]methanol?
The InChIKey is JTUMWOQUKTZROX-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H20N2O2/c1-2-10-5-3-4-6-12(10)17-13-8-7-11(9-16)14-15-13/h7-8,10,12,16H,2-6,9H2,1H3.
What are the key properties of [6-(2-ethylcyclohexyl)oxypyridazin-3-yl]methanol?
[6-(2-ethylcyclohexyl)oxypyridazin-3-yl]methanol has a molecular weight of 236.31 g/mol, XLogP of 2.32, 4 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for [6-(2-ethylcyclohexyl)oxypyridazin-3-yl]methanol is sourced from PubChem (CID 61257773), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).