[6-(3-methylcyclohexyl)oxypyridazin-3-yl]methanol

C12H18N2O2 — CID 61257169

IUPAC[6-(3-methylcyclohexyl)oxypyridazin-3-yl]methanol
SMILESCC1CCCC(Oc2ccc(CO)nn2)C1
InChIInChI=1S/C12H18N2O2/c1-9-3-2-4-11(7-9)16-12-6-5-10(8-15)13-14-12/h5-6,9,11,15H,2-4,7-8H2,1H3
InChIKeyIPTZOGCYZPYWKF-UHFFFAOYSA-N
MW222.29 g/mol
LogP1.93
Rot. Bonds3

About [6-(3-methylcyclohexyl)oxypyridazin-3-yl]methanol

[6-(3-methylcyclohexyl)oxypyridazin-3-yl]methanol (PubChem CID 61257169) has the molecular formula C12H18N2O2 and a molecular weight of 222.29 g/mol. Its IUPAC name is [6-(3-methylcyclohexyl)oxypyridazin-3-yl]methanol.

Molecular Properties

Compound Name[6-(3-methylcyclohexyl)oxypyridazin-3-yl]methanol
PubChem CID61257169
Molecular FormulaC12H18N2O2
Molecular Weight222.29 g/mol
Exact Mass222.14
IUPAC Name[6-(3-methylcyclohexyl)oxypyridazin-3-yl]methanol
SMILESCC1CCCC(Oc2ccc(CO)nn2)C1
InChIInChI=1S/C12H18N2O2/c1-9-3-2-4-11(7-9)16-12-6-5-10(8-15)13-14-12/h5-6,9,11,15H,2-4,7-8H2,1H3
InChIKeyIPTZOGCYZPYWKF-UHFFFAOYSA-N
XLogP1.93
TPSA55.24 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500222.29
LogP ≤ 51.93
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of [6-(3-methylcyclohexyl)oxypyridazin-3-yl]methanol?
The IUPAC name of [6-(3-methylcyclohexyl)oxypyridazin-3-yl]methanol (CID 61257169) is [6-(3-methylcyclohexyl)oxypyridazin-3-yl]methanol.
What is the SMILES notation for [6-(3-methylcyclohexyl)oxypyridazin-3-yl]methanol?
The canonical SMILES for [6-(3-methylcyclohexyl)oxypyridazin-3-yl]methanol is CC1CCCC(Oc2ccc(CO)nn2)C1.
What is the InChIKey of [6-(3-methylcyclohexyl)oxypyridazin-3-yl]methanol?
The InChIKey is IPTZOGCYZPYWKF-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H18N2O2/c1-9-3-2-4-11(7-9)16-12-6-5-10(8-15)13-14-12/h5-6,9,11,15H,2-4,7-8H2,1H3.
What are the key properties of [6-(3-methylcyclohexyl)oxypyridazin-3-yl]methanol?
[6-(3-methylcyclohexyl)oxypyridazin-3-yl]methanol has a molecular weight of 222.29 g/mol, XLogP of 1.93, 3 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for [6-(3-methylcyclohexyl)oxypyridazin-3-yl]methanol is sourced from PubChem (CID 61257169), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).