4-[2-(4-ethoxycyclohexyl)propan-2-yl]cyclohexan-1-ol

C17H32O2 — CID 70671036

IUPAC4-[2-(4-ethoxycyclohexyl)propan-2-yl]cyclohexan-1-ol
SMILESCCOC1CCC(C(C)(C)C2CCC(O)CC2)CC1
InChIInChI=1S/C17H32O2/c1-4-19-16-11-7-14(8-12-16)17(2,3)13-5-9-15(18)10-6-13/h13-16,18H,4-12H2,1-3H3
InChIKeyNOSNAQBHLNFZCO-UHFFFAOYSA-N
MW268.44 g/mol
LogP4.16
Rot. Bonds4

About 4-[2-(4-ethoxycyclohexyl)propan-2-yl]cyclohexan-1-ol

4-[2-(4-ethoxycyclohexyl)propan-2-yl]cyclohexan-1-ol (PubChem CID 70671036) has the molecular formula C17H32O2 and a molecular weight of 268.44 g/mol. Its IUPAC name is 4-[2-(4-ethoxycyclohexyl)propan-2-yl]cyclohexan-1-ol.

Molecular Properties

Compound Name4-[2-(4-ethoxycyclohexyl)propan-2-yl]cyclohexan-1-ol
PubChem CID70671036
Molecular FormulaC17H32O2
Molecular Weight268.44 g/mol
Exact Mass268.24
IUPAC Name4-[2-(4-ethoxycyclohexyl)propan-2-yl]cyclohexan-1-ol
SMILESCCOC1CCC(C(C)(C)C2CCC(O)CC2)CC1
InChIInChI=1S/C17H32O2/c1-4-19-16-11-7-14(8-12-16)17(2,3)13-5-9-15(18)10-6-13/h13-16,18H,4-12H2,1-3H3
InChIKeyNOSNAQBHLNFZCO-UHFFFAOYSA-N
XLogP4.16
TPSA29.46 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500268.44
LogP ≤ 54.16
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

4-[2-[4-(oxiran-2-ylmethoxy)cyclohexyl]propan-2-yl]cyclohexan-1-ol
CID 89323282
4-[2-[4-[1-[4-[1-[4-[2-(4-hydroxycyclohexyl)propan-2-yl]cyclohexyl]oxyethoxy]cyclohexyl]oxyethoxy]cyclohexyl]propan-2-yl]cyclohexan-1-ol
CID 140509318
4-(2-cyclohexylpropan-2-yl)cyclohexan-1-ol
CID 19694020
[4-[2-(4-hydroxycyclohexyl)propan-2-yl]cyclohexyl] 2-methylpropanoate
CID 150017281
4-(4-tert-butylcyclohexyl)oxycyclohexan-1-ol
CID 102283442
3-[4-[2-[4-(2-hydroxyethoxy)cyclohexyl]propan-2-yl]cyclohexyl]oxypropan-1-ol
CID 138483628
4-[2-(4-hydroxycyclohexyl)propan-2-yl]cyclohexan-1-ol;[2-(hydroxymethyl)cyclohexyl]methanol
CID 67640384
2-[[4-[2-[4-[1,1-bis[4-(oxiran-2-ylmethoxy)cyclohexyl]ethyl]cyclohexyl]propan-2-yl]cyclohexyl]oxymethyl]oxirane
CID 118282146
4-prop-2-enoxycyclohexan-1-ol
CID 23031036
1,3-bis[[4-[2-[4-(oxiran-2-ylmethoxy)cyclohexyl]propan-2-yl]cyclohexyl]oxy]propan-2-ol;2-[[4-[2-[4-(oxiran-2-ylmethoxy)cyclohexyl]propan-2-yl]cyclohexyl]oxymethyl]oxirane
CID 161181502
4-[2-[4-[4,4-bis(trifluoromethyl)oxetan-2-yl]oxycyclohexyl]propan-2-yl]cyclohexan-1-ol
CID 89385994
cyclohexane-1,4-diol;ethoxyethane
CID 174832685

Frequently Asked Questions

What is the IUPAC name of 4-[2-(4-ethoxycyclohexyl)propan-2-yl]cyclohexan-1-ol?
The IUPAC name of 4-[2-(4-ethoxycyclohexyl)propan-2-yl]cyclohexan-1-ol (CID 70671036) is 4-[2-(4-ethoxycyclohexyl)propan-2-yl]cyclohexan-1-ol.
What is the SMILES notation for 4-[2-(4-ethoxycyclohexyl)propan-2-yl]cyclohexan-1-ol?
The canonical SMILES for 4-[2-(4-ethoxycyclohexyl)propan-2-yl]cyclohexan-1-ol is CCOC1CCC(C(C)(C)C2CCC(O)CC2)CC1.
What is the InChIKey of 4-[2-(4-ethoxycyclohexyl)propan-2-yl]cyclohexan-1-ol?
The InChIKey is NOSNAQBHLNFZCO-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H32O2/c1-4-19-16-11-7-14(8-12-16)17(2,3)13-5-9-15(18)10-6-13/h13-16,18H,4-12H2,1-3H3.
What are the key properties of 4-[2-(4-ethoxycyclohexyl)propan-2-yl]cyclohexan-1-ol?
4-[2-(4-ethoxycyclohexyl)propan-2-yl]cyclohexan-1-ol has a molecular weight of 268.44 g/mol, XLogP of 4.16, 4 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 4-[2-(4-ethoxycyclohexyl)propan-2-yl]cyclohexan-1-ol is sourced from PubChem (CID 70671036), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).