(3,5-dimethylcyclohexyl)-(3-ethyl-6-methylpyridazin-4-yl)methanol

C16H26N2O — CID 105102866

IUPAC(3,5-dimethylcyclohexyl)-(3-ethyl-6-methylpyridazin-4-yl)methanol
SMILESCCc1nnc(C)cc1C(O)C1CC(C)CC(C)C1
InChIInChI=1S/C16H26N2O/c1-5-15-14(9-12(4)17-18-15)16(19)13-7-10(2)6-11(3)8-13/h9-11,13,16,19H,5-8H2,1-4H3
InChIKeyNZTKFKGIAHQDNX-UHFFFAOYSA-N
MW262.40 g/mol
LogP3.45
Rot. Bonds3

About (3,5-dimethylcyclohexyl)-(3-ethyl-6-methylpyridazin-4-yl)methanol

(3,5-dimethylcyclohexyl)-(3-ethyl-6-methylpyridazin-4-yl)methanol (PubChem CID 105102866) has the molecular formula C16H26N2O and a molecular weight of 262.40 g/mol. Its IUPAC name is (3,5-dimethylcyclohexyl)-(3-ethyl-6-methylpyridazin-4-yl)methanol.

Molecular Properties

Compound Name(3,5-dimethylcyclohexyl)-(3-ethyl-6-methylpyridazin-4-yl)methanol
PubChem CID105102866
Molecular FormulaC16H26N2O
Molecular Weight262.40 g/mol
Exact Mass262.20
IUPAC Name(3,5-dimethylcyclohexyl)-(3-ethyl-6-methylpyridazin-4-yl)methanol
SMILESCCc1nnc(C)cc1C(O)C1CC(C)CC(C)C1
InChIInChI=1S/C16H26N2O/c1-5-15-14(9-12(4)17-18-15)16(19)13-7-10(2)6-11(3)8-13/h9-11,13,16,19H,5-8H2,1-4H3
InChIKeyNZTKFKGIAHQDNX-UHFFFAOYSA-N
XLogP3.45
TPSA46.01 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500262.40
LogP ≤ 53.45
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

(3-ethyl-6-methylpyridazin-4-yl)-(6-oxaspiro[4.5]decan-9-yl)methanol
CID 105116217
2-ethoxy-1-(3-ethyl-6-methylpyridazin-4-yl)ethanol
CID 105111769
1-(3-ethyl-6-methylpyridazin-4-yl)-N-methyl-1-(4-methylcyclohexyl)methanamine
CID 105153848
2-ethyl-1-(3-ethyl-6-methylpyridazin-4-yl)butan-1-ol
CID 105114654
cycloheptyl-(3-ethyl-6-methylpyridazin-4-yl)methanamine
CID 105176345
1-(3-ethyl-6-methylpyridazin-4-yl)-2-propoxyethanol
CID 105111921
2-cyclopropyl-1-(3-ethyl-6-methylpyridazin-4-yl)ethanamine
CID 105152857
(3,5-dimethylcyclohexyl)-(2,5-dimethylthiophen-3-yl)methanol
CID 64729274
2-bicyclo[2.2.1]heptanyl-(3-ethyl-6-methylpyridazin-4-yl)methanamine
CID 114246839
N-[cyclohexyl-(3-ethyl-6-methylpyridazin-4-yl)methyl]ethanamine
CID 105079704
1-(3-ethyl-6-methylpyridazin-4-yl)-2-pyridin-4-ylethanol
CID 105108021
(3-cyclopropyloxyphenyl)-(3-ethyl-6-methylpyridazin-4-yl)methanol
CID 105131524

Frequently Asked Questions

What is the IUPAC name of (3,5-dimethylcyclohexyl)-(3-ethyl-6-methylpyridazin-4-yl)methanol?
The IUPAC name of (3,5-dimethylcyclohexyl)-(3-ethyl-6-methylpyridazin-4-yl)methanol (CID 105102866) is (3,5-dimethylcyclohexyl)-(3-ethyl-6-methylpyridazin-4-yl)methanol.
What is the SMILES notation for (3,5-dimethylcyclohexyl)-(3-ethyl-6-methylpyridazin-4-yl)methanol?
The canonical SMILES for (3,5-dimethylcyclohexyl)-(3-ethyl-6-methylpyridazin-4-yl)methanol is CCc1nnc(C)cc1C(O)C1CC(C)CC(C)C1.
What is the InChIKey of (3,5-dimethylcyclohexyl)-(3-ethyl-6-methylpyridazin-4-yl)methanol?
The InChIKey is NZTKFKGIAHQDNX-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H26N2O/c1-5-15-14(9-12(4)17-18-15)16(19)13-7-10(2)6-11(3)8-13/h9-11,13,16,19H,5-8H2,1-4H3.
What are the key properties of (3,5-dimethylcyclohexyl)-(3-ethyl-6-methylpyridazin-4-yl)methanol?
(3,5-dimethylcyclohexyl)-(3-ethyl-6-methylpyridazin-4-yl)methanol has a molecular weight of 262.40 g/mol, XLogP of 3.45, 3 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for (3,5-dimethylcyclohexyl)-(3-ethyl-6-methylpyridazin-4-yl)methanol is sourced from PubChem (CID 105102866), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).