1-(3-ethylcyclohexyl)-2-(4-methoxy-3,5-dimethyl-2-pyridinyl)ethanol

C18H29NO2 — CID 65401934

IUPAC1-(3-ethylcyclohexyl)-2-(4-methoxy-3,5-dimethyl-2-pyridinyl)ethanol
SMILESCCC1CCCC(C(O)Cc2ncc(C)c(OC)c2C)C1
InChIInChI=1S/C18H29NO2/c1-5-14-7-6-8-15(9-14)17(20)10-16-13(3)18(21-4)12(2)11-19-16/h11,14-15,17,20H,5-10H2,1-4H3
InChIKeyWSSJRKFOKGLQFO-UHFFFAOYSA-N
MW291.44 g/mol
LogP3.83
Rot. Bonds5

About 1-(3-ethylcyclohexyl)-2-(4-methoxy-3,5-dimethyl-2-pyridinyl)ethanol

1-(3-ethylcyclohexyl)-2-(4-methoxy-3,5-dimethyl-2-pyridinyl)ethanol (PubChem CID 65401934) has the molecular formula C18H29NO2 and a molecular weight of 291.44 g/mol. Its IUPAC name is 1-(3-ethylcyclohexyl)-2-(4-methoxy-3,5-dimethyl-2-pyridinyl)ethanol.

Molecular Properties

Compound Name1-(3-ethylcyclohexyl)-2-(4-methoxy-3,5-dimethyl-2-pyridinyl)ethanol
PubChem CID65401934
Molecular FormulaC18H29NO2
Molecular Weight291.44 g/mol
Exact Mass291.22
IUPAC Name1-(3-ethylcyclohexyl)-2-(4-methoxy-3,5-dimethyl-2-pyridinyl)ethanol
SMILESCCC1CCCC(C(O)Cc2ncc(C)c(OC)c2C)C1
InChIInChI=1S/C18H29NO2/c1-5-14-7-6-8-15(9-14)17(20)10-16-13(3)18(21-4)12(2)11-19-16/h11,14-15,17,20H,5-10H2,1-4H3
InChIKeyWSSJRKFOKGLQFO-UHFFFAOYSA-N
XLogP3.83
TPSA42.35 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500291.44
LogP ≤ 53.83
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Analyze 1-(3-ethylcyclohexyl)-2-(4-methoxy-3,5-dimethyl-2-pyridinyl)ethanol with MolForge

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Related Compounds

2-(4-methoxy-3,5-dimethyl-2-pyridinyl)-1-(3-methylcyclopentyl)ethanol
CID 65401765
1-cyclopropyl-3-(4-methoxy-3,5-dimethyl-2-pyridinyl)propane-1,2-diol
CID 103457017
1-cyclopentyl-N-ethyl-2-(4-methoxy-3,5-dimethyl-2-pyridinyl)ethanamine
CID 62601412
1-cyclohexyl-N-ethyl-2-(4-methoxy-3,5-dimethyl-2-pyridinyl)ethanamine
CID 62601994
1-(4-methoxy-3,5-dimethyl-2-pyridinyl)-3,3-dimethylbutan-2-ol
CID 62606138
1-[1-[(4-methoxy-3,5-dimethyl-2-pyridinyl)methyl]piperidin-4-yl]ethanol
CID 103655825
1-cyclopropyl-2-(4-methoxy-3,5-dimethyl-2-pyridinyl)-N-methylethanamine
CID 62600019
1-(4-methoxy-3,5-dimethyl-2-pyridinyl)-4,5,5-trimethylhexan-2-ol
CID 115788139
1-(3-ethylcyclohexyl)-2-(2-methoxy-5-methylphenyl)ethanol
CID 65401725
1-[1-hydroxy-2-(4-methoxy-3,5-dimethyl-2-pyridinyl)ethyl]cyclopentan-1-ol
CID 103448486
N-[2-[(4-methoxy-3,5-dimethyl-2-pyridinyl)methyl]butyl]cyclopropanamine
CID 62529169
2-[(4-methoxy-3,5-dimethyl-2-pyridinyl)methyl]cyclopentan-1-ol
CID 55125071

Frequently Asked Questions

What is the IUPAC name of 1-(3-ethylcyclohexyl)-2-(4-methoxy-3,5-dimethyl-2-pyridinyl)ethanol?
The IUPAC name of 1-(3-ethylcyclohexyl)-2-(4-methoxy-3,5-dimethyl-2-pyridinyl)ethanol (CID 65401934) is 1-(3-ethylcyclohexyl)-2-(4-methoxy-3,5-dimethyl-2-pyridinyl)ethanol.
What is the SMILES notation for 1-(3-ethylcyclohexyl)-2-(4-methoxy-3,5-dimethyl-2-pyridinyl)ethanol?
The canonical SMILES for 1-(3-ethylcyclohexyl)-2-(4-methoxy-3,5-dimethyl-2-pyridinyl)ethanol is CCC1CCCC(C(O)Cc2ncc(C)c(OC)c2C)C1.
What is the InChIKey of 1-(3-ethylcyclohexyl)-2-(4-methoxy-3,5-dimethyl-2-pyridinyl)ethanol?
The InChIKey is WSSJRKFOKGLQFO-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H29NO2/c1-5-14-7-6-8-15(9-14)17(20)10-16-13(3)18(21-4)12(2)11-19-16/h11,14-15,17,20H,5-10H2,1-4H3.
What are the key properties of 1-(3-ethylcyclohexyl)-2-(4-methoxy-3,5-dimethyl-2-pyridinyl)ethanol?
1-(3-ethylcyclohexyl)-2-(4-methoxy-3,5-dimethyl-2-pyridinyl)ethanol has a molecular weight of 291.44 g/mol, XLogP of 3.83, 5 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(3-ethylcyclohexyl)-2-(4-methoxy-3,5-dimethyl-2-pyridinyl)ethanol is sourced from PubChem (CID 65401934), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).