(2,2-dimethylcyclohexyl)-(2-ethoxyphenyl)methanol

C17H26O2 — CID 107192228

IUPAC(2,2-dimethylcyclohexyl)-(2-ethoxyphenyl)methanol
SMILESCCOc1ccccc1C(O)C1CCCCC1(C)C
InChIInChI=1S/C17H26O2/c1-4-19-15-11-6-5-9-13(15)16(18)14-10-7-8-12-17(14,2)3/h5-6,9,11,14,16,18H,4,7-8,10,12H2,1-3H3
InChIKeyMFJYDCHTQVHOIY-UHFFFAOYSA-N
MW262.39 g/mol
LogP4.34
Rot. Bonds4

About (2,2-dimethylcyclohexyl)-(2-ethoxyphenyl)methanol

(2,2-dimethylcyclohexyl)-(2-ethoxyphenyl)methanol (PubChem CID 107192228) has the molecular formula C17H26O2 and a molecular weight of 262.39 g/mol. Its IUPAC name is (2,2-dimethylcyclohexyl)-(2-ethoxyphenyl)methanol.

Molecular Properties

Compound Name(2,2-dimethylcyclohexyl)-(2-ethoxyphenyl)methanol
PubChem CID107192228
Molecular FormulaC17H26O2
Molecular Weight262.39 g/mol
Exact Mass262.19
IUPAC Name(2,2-dimethylcyclohexyl)-(2-ethoxyphenyl)methanol
SMILESCCOc1ccccc1C(O)C1CCCCC1(C)C
InChIInChI=1S/C17H26O2/c1-4-19-15-11-6-5-9-13(15)16(18)14-10-7-8-12-17(14,2)3/h5-6,9,11,14,16,18H,4,7-8,10,12H2,1-3H3
InChIKeyMFJYDCHTQVHOIY-UHFFFAOYSA-N
XLogP4.34
TPSA29.46 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500262.39
LogP ≤ 54.34
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

(2,2-dimethylcyclohexyl)-(2-methoxyphenyl)methanol
CID 107191971
(5-chloro-2-methoxyphenyl)-(2,2-dimethylcyclohexyl)methanol
CID 107181861
4-bromo-2-[chloro-(2,2-dimethylcyclohexyl)methyl]-1-ethoxybenzene
CID 107182084
[1-(dimethylamino)cyclopentyl]-(2-ethoxyphenyl)methanol
CID 79067542
(2-ethoxyphenyl)-(4-methylcyclohexyl)methanol
CID 62801891
(2,2-dimethylcyclopentyl)-(4-methoxynaphthalen-1-yl)methanol
CID 107181495
3-amino-2-(2-chlorophenyl)-1-(2,2-dimethylcyclohexyl)propan-1-ol
CID 107185223
(3-bromo-2,4-dimethoxyphenyl)-(2,2-dimethylcyclohexyl)methanol
CID 107181873
(2,2-dimethylcyclohexyl)-(4-ethoxyphenyl)methanamine
CID 107176964
(3-bromo-2-fluorophenyl)-(2,2-dimethylcyclopentyl)methanol
CID 107193133
(4-cyclopropyloxyphenyl)-(2,2-dimethylcyclohexyl)methanol
CID 107193010
(2,2-dimethylcyclopentyl)-(4-fluoronaphthalen-1-yl)methanol
CID 107181750

Frequently Asked Questions

What is the IUPAC name of (2,2-dimethylcyclohexyl)-(2-ethoxyphenyl)methanol?
The IUPAC name of (2,2-dimethylcyclohexyl)-(2-ethoxyphenyl)methanol (CID 107192228) is (2,2-dimethylcyclohexyl)-(2-ethoxyphenyl)methanol.
What is the SMILES notation for (2,2-dimethylcyclohexyl)-(2-ethoxyphenyl)methanol?
The canonical SMILES for (2,2-dimethylcyclohexyl)-(2-ethoxyphenyl)methanol is CCOc1ccccc1C(O)C1CCCCC1(C)C.
What is the InChIKey of (2,2-dimethylcyclohexyl)-(2-ethoxyphenyl)methanol?
The InChIKey is MFJYDCHTQVHOIY-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H26O2/c1-4-19-15-11-6-5-9-13(15)16(18)14-10-7-8-12-17(14,2)3/h5-6,9,11,14,16,18H,4,7-8,10,12H2,1-3H3.
What are the key properties of (2,2-dimethylcyclohexyl)-(2-ethoxyphenyl)methanol?
(2,2-dimethylcyclohexyl)-(2-ethoxyphenyl)methanol has a molecular weight of 262.39 g/mol, XLogP of 4.34, 4 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for (2,2-dimethylcyclohexyl)-(2-ethoxyphenyl)methanol is sourced from PubChem (CID 107192228), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).