1-(ethoxymethyl)-2-phenylcyclohexan-1-ol

C15H22O2 — CID 79566677

IUPAC1-(ethoxymethyl)-2-phenylcyclohexan-1-ol
SMILESCCOCC1(O)CCCCC1c1ccccc1
InChIInChI=1S/C15H22O2/c1-2-17-12-15(16)11-7-6-10-14(15)13-8-4-3-5-9-13/h3-5,8-9,14,16H,2,6-7,10-12H2,1H3
InChIKeyJJEKRWCVRHEZMT-UHFFFAOYSA-N
MW234.34 g/mol
LogP3.11
Rot. Bonds4

About 1-(ethoxymethyl)-2-phenylcyclohexan-1-ol

1-(ethoxymethyl)-2-phenylcyclohexan-1-ol (PubChem CID 79566677) has the molecular formula C15H22O2 and a molecular weight of 234.34 g/mol. Its IUPAC name is 1-(ethoxymethyl)-2-phenylcyclohexan-1-ol.

Molecular Properties

Compound Name1-(ethoxymethyl)-2-phenylcyclohexan-1-ol
PubChem CID79566677
Molecular FormulaC15H22O2
Molecular Weight234.34 g/mol
Exact Mass234.16
IUPAC Name1-(ethoxymethyl)-2-phenylcyclohexan-1-ol
SMILESCCOCC1(O)CCCCC1c1ccccc1
InChIInChI=1S/C15H22O2/c1-2-17-12-15(16)11-7-6-10-14(15)13-8-4-3-5-9-13/h3-5,8-9,14,16H,2,6-7,10-12H2,1H3
InChIKeyJJEKRWCVRHEZMT-UHFFFAOYSA-N
XLogP3.11
TPSA29.46 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500234.34
LogP ≤ 53.11
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

1-(2-methylbutyl)-2-phenylcyclohexan-1-ol
CID 65147898
2-[(1S,2S)-1-hydroxy-2-phenylcyclohexyl]acetic acid
CID 40501081
2-phenyl-1-prop-2-ynylcyclohexan-1-ol
CID 63222408
2-tert-butyl-1-(ethoxymethyl)cyclohexan-1-ol
CID 79568315
1-[(2-chlorophenyl)methyl]-2-phenylcyclohexan-1-ol
CID 60798196
1-[(3-methylphenyl)methyl]-2-phenylcyclohexan-1-ol
CID 60797806
1-[(1-ethylimidazol-2-yl)methyl]-2-phenylcyclohexan-1-ol
CID 79734846
1-[(1-methylpyrazol-3-yl)methyl]-2-phenylcyclohexan-1-ol
CID 82870077
2-phenyl-1-(pyridin-3-ylmethyl)cyclohexan-1-ol
CID 104735628
ethyl 2-phenyl-1-(propylamino)cyclohexane-1-carboxylate
CID 105401874
methyl 2-[2-phenyl-1-(propylamino)cyclohexyl]acetate
CID 105403784
ethyl 2-phenyl-1-propylcyclohexane-1-carboxylate
CID 70449516

Frequently Asked Questions

What is the IUPAC name of 1-(ethoxymethyl)-2-phenylcyclohexan-1-ol?
The IUPAC name of 1-(ethoxymethyl)-2-phenylcyclohexan-1-ol (CID 79566677) is 1-(ethoxymethyl)-2-phenylcyclohexan-1-ol.
What is the SMILES notation for 1-(ethoxymethyl)-2-phenylcyclohexan-1-ol?
The canonical SMILES for 1-(ethoxymethyl)-2-phenylcyclohexan-1-ol is CCOCC1(O)CCCCC1c1ccccc1.
What is the InChIKey of 1-(ethoxymethyl)-2-phenylcyclohexan-1-ol?
The InChIKey is JJEKRWCVRHEZMT-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H22O2/c1-2-17-12-15(16)11-7-6-10-14(15)13-8-4-3-5-9-13/h3-5,8-9,14,16H,2,6-7,10-12H2,1H3.
What are the key properties of 1-(ethoxymethyl)-2-phenylcyclohexan-1-ol?
1-(ethoxymethyl)-2-phenylcyclohexan-1-ol has a molecular weight of 234.34 g/mol, XLogP of 3.11, 4 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(ethoxymethyl)-2-phenylcyclohexan-1-ol is sourced from PubChem (CID 79566677), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).