[1-(dimethylamino)-4-methylcyclohexyl]-(4-ethoxyphenyl)methanol

C18H29NO2 — CID 79061631

IUPAC[1-(dimethylamino)-4-methylcyclohexyl]-(4-ethoxyphenyl)methanol
SMILESCCOc1ccc(C(O)C2(N(C)C)CCC(C)CC2)cc1
InChIInChI=1S/C18H29NO2/c1-5-21-16-8-6-15(7-9-16)17(20)18(19(3)4)12-10-14(2)11-13-18/h6-9,14,17,20H,5,10-13H2,1-4H3
InChIKeyUTFKWFPMXYKNLM-UHFFFAOYSA-N
MW291.44 g/mol
LogP3.63
Rot. Bonds5

About [1-(dimethylamino)-4-methylcyclohexyl]-(4-ethoxyphenyl)methanol

[1-(dimethylamino)-4-methylcyclohexyl]-(4-ethoxyphenyl)methanol (PubChem CID 79061631) has the molecular formula C18H29NO2 and a molecular weight of 291.44 g/mol. Its IUPAC name is [1-(dimethylamino)-4-methylcyclohexyl]-(4-ethoxyphenyl)methanol.

Molecular Properties

Compound Name[1-(dimethylamino)-4-methylcyclohexyl]-(4-ethoxyphenyl)methanol
PubChem CID79061631
Molecular FormulaC18H29NO2
Molecular Weight291.44 g/mol
Exact Mass291.22
IUPAC Name[1-(dimethylamino)-4-methylcyclohexyl]-(4-ethoxyphenyl)methanol
SMILESCCOc1ccc(C(O)C2(N(C)C)CCC(C)CC2)cc1
InChIInChI=1S/C18H29NO2/c1-5-21-16-8-6-15(7-9-16)17(20)18(19(3)4)12-10-14(2)11-13-18/h6-9,14,17,20H,5,10-13H2,1-4H3
InChIKeyUTFKWFPMXYKNLM-UHFFFAOYSA-N
XLogP3.63
TPSA32.70 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 ≤ 53.63
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Analyze [1-(dimethylamino)-4-methylcyclohexyl]-(4-ethoxyphenyl)methanol with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

1-(4-ethoxyphenyl)-4-methylcyclohexan-1-ol
CID 62788999
[1-(dimethylamino)-4-methylcyclohexyl]-pyridin-3-ylmethanol
CID 79074201
2-cyclopentyl-1-(4-ethoxyphenyl)ethanol
CID 61101248
(1-ethoxy-4-methylcyclohexyl)-(3-ethoxyphenyl)methanol
CID 116754822
1-[(4-ethoxyphenyl)-hydroxymethyl]cyclopentane-1-carbonitrile
CID 79130086
1-[amino-(2-ethoxyphenyl)methyl]-N,N,4-trimethylcyclohexan-1-amine
CID 79061084
1-(4-ethoxyphenyl)-N-methyl-N-(4-methylcyclohexyl)ethane-1,2-diamine
CID 61439040
(4-cyclopropyloxyphenyl)-(4-ethoxyphenyl)methanol
CID 114518502
3-amino-1-cyclopropyl-2-(4-ethoxyphenyl)propan-1-ol
CID 65187865
(R)-(4-ethoxyphenyl)-piperidin-1-ium-4-ylmethanol
CID 7348196
N-[(4-ethoxyphenyl)-(4-methylcyclohexyl)methyl]propan-1-amine
CID 63415910
[1-(dimethylamino)-4-methylcyclohexyl]-(2-methylpyrazol-3-yl)methanol
CID 79074868

Frequently Asked Questions

What is the IUPAC name of [1-(dimethylamino)-4-methylcyclohexyl]-(4-ethoxyphenyl)methanol?
The IUPAC name of [1-(dimethylamino)-4-methylcyclohexyl]-(4-ethoxyphenyl)methanol (CID 79061631) is [1-(dimethylamino)-4-methylcyclohexyl]-(4-ethoxyphenyl)methanol.
What is the SMILES notation for [1-(dimethylamino)-4-methylcyclohexyl]-(4-ethoxyphenyl)methanol?
The canonical SMILES for [1-(dimethylamino)-4-methylcyclohexyl]-(4-ethoxyphenyl)methanol is CCOc1ccc(C(O)C2(N(C)C)CCC(C)CC2)cc1.
What is the InChIKey of [1-(dimethylamino)-4-methylcyclohexyl]-(4-ethoxyphenyl)methanol?
The InChIKey is UTFKWFPMXYKNLM-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H29NO2/c1-5-21-16-8-6-15(7-9-16)17(20)18(19(3)4)12-10-14(2)11-13-18/h6-9,14,17,20H,5,10-13H2,1-4H3.
What are the key properties of [1-(dimethylamino)-4-methylcyclohexyl]-(4-ethoxyphenyl)methanol?
[1-(dimethylamino)-4-methylcyclohexyl]-(4-ethoxyphenyl)methanol has a molecular weight of 291.44 g/mol, XLogP of 3.63, 5 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for [1-(dimethylamino)-4-methylcyclohexyl]-(4-ethoxyphenyl)methanol is sourced from PubChem (CID 79061631), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).