(3,6-dimethylpyridazin-4-yl)-(3-ethylcyclohexyl)methanol

C15H24N2O — CID 105104447

IUPAC(3,6-dimethylpyridazin-4-yl)-(3-ethylcyclohexyl)methanol
SMILESCCC1CCCC(C(O)c2cc(C)nnc2C)C1
InChIInChI=1S/C15H24N2O/c1-4-12-6-5-7-13(9-12)15(18)14-8-10(2)16-17-11(14)3/h8,12-13,15,18H,4-7,9H2,1-3H3
InChIKeyZODNRSIGSOAUSJ-UHFFFAOYSA-N
MW248.37 g/mol
LogP3.34
Rot. Bonds3

About (3,6-dimethylpyridazin-4-yl)-(3-ethylcyclohexyl)methanol

(3,6-dimethylpyridazin-4-yl)-(3-ethylcyclohexyl)methanol (PubChem CID 105104447) has the molecular formula C15H24N2O and a molecular weight of 248.37 g/mol. Its IUPAC name is (3,6-dimethylpyridazin-4-yl)-(3-ethylcyclohexyl)methanol.

Molecular Properties

Compound Name(3,6-dimethylpyridazin-4-yl)-(3-ethylcyclohexyl)methanol
PubChem CID105104447
Molecular FormulaC15H24N2O
Molecular Weight248.37 g/mol
Exact Mass248.19
IUPAC Name(3,6-dimethylpyridazin-4-yl)-(3-ethylcyclohexyl)methanol
SMILESCCC1CCCC(C(O)c2cc(C)nnc2C)C1
InChIInChI=1S/C15H24N2O/c1-4-12-6-5-7-13(9-12)15(18)14-8-10(2)16-17-11(14)3/h8,12-13,15,18H,4-7,9H2,1-3H3
InChIKeyZODNRSIGSOAUSJ-UHFFFAOYSA-N
XLogP3.34
TPSA46.01 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500248.37
LogP ≤ 53.34
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

N-[(3,6-dimethylpyridazin-4-yl)-(3-ethylcyclohexyl)methyl]propan-1-amine
CID 105156216
(4-bromo-2-methylphenyl)-(3-ethylcyclohexyl)methanol
CID 115808444
(2-bromo-3-methylphenyl)-(3-ethylcyclohexyl)methanol
CID 107985730
(3-ethylcyclohexyl)-(2,4,6-trifluorophenyl)methanol
CID 115808567
(1,3-diethylpyrazol-5-yl)-(3-ethylcyclohexyl)methanol
CID 105104498
(3-ethylcyclohexyl)-(2,3,4,5,6-pentafluorophenyl)methanol
CID 115808432
(3-chloro-2-fluorophenyl)-(3-ethylcyclohexyl)methanol
CID 64713267
(5-bromothiophen-3-yl)-(3-ethylcyclohexyl)methanol
CID 105104394
N-[cyclohexyl-(3,6-dimethylpyridazin-4-yl)methyl]ethanamine
CID 105079539
(3-ethylcyclohexyl)-(1-methylimidazol-2-yl)methanol
CID 65400333
(3-ethylcyclohexyl)-(3-methylimidazol-4-yl)methanol
CID 66117130
N-[(3,6-dimethylpyridazin-4-yl)-(4-ethylcyclohexyl)methyl]propan-1-amine
CID 105155357

Frequently Asked Questions

What is the IUPAC name of (3,6-dimethylpyridazin-4-yl)-(3-ethylcyclohexyl)methanol?
The IUPAC name of (3,6-dimethylpyridazin-4-yl)-(3-ethylcyclohexyl)methanol (CID 105104447) is (3,6-dimethylpyridazin-4-yl)-(3-ethylcyclohexyl)methanol.
What is the SMILES notation for (3,6-dimethylpyridazin-4-yl)-(3-ethylcyclohexyl)methanol?
The canonical SMILES for (3,6-dimethylpyridazin-4-yl)-(3-ethylcyclohexyl)methanol is CCC1CCCC(C(O)c2cc(C)nnc2C)C1.
What is the InChIKey of (3,6-dimethylpyridazin-4-yl)-(3-ethylcyclohexyl)methanol?
The InChIKey is ZODNRSIGSOAUSJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H24N2O/c1-4-12-6-5-7-13(9-12)15(18)14-8-10(2)16-17-11(14)3/h8,12-13,15,18H,4-7,9H2,1-3H3.
What are the key properties of (3,6-dimethylpyridazin-4-yl)-(3-ethylcyclohexyl)methanol?
(3,6-dimethylpyridazin-4-yl)-(3-ethylcyclohexyl)methanol has a molecular weight of 248.37 g/mol, XLogP of 3.34, 3 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for (3,6-dimethylpyridazin-4-yl)-(3-ethylcyclohexyl)methanol is sourced from PubChem (CID 105104447), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).