4-(4-phenoxycyclohexylidene)cyclohexan-1-ol

C18H24O2 — CID 67824653

IUPAC4-(4-phenoxycyclohexylidene)cyclohexan-1-ol
SMILESOC1CCC(=C2CCC(Oc3ccccc3)CC2)CC1
InChIInChI=1S/C18H24O2/c19-16-10-6-14(7-11-16)15-8-12-18(13-9-15)20-17-4-2-1-3-5-17/h1-5,16,18-19H,6-13H2/b15-14-
InChIKeyZRZZEUPZDBKHPK-PFONDFGASA-N
MW272.39 g/mol
LogP4.24
Rot. Bonds2

About 4-(4-phenoxycyclohexylidene)cyclohexan-1-ol

4-(4-phenoxycyclohexylidene)cyclohexan-1-ol (PubChem CID 67824653) has the molecular formula C18H24O2 and a molecular weight of 272.39 g/mol. Its IUPAC name is 4-(4-phenoxycyclohexylidene)cyclohexan-1-ol.

Molecular Properties

Compound Name4-(4-phenoxycyclohexylidene)cyclohexan-1-ol
PubChem CID67824653
Molecular FormulaC18H24O2
Molecular Weight272.39 g/mol
Exact Mass272.18
IUPAC Name4-(4-phenoxycyclohexylidene)cyclohexan-1-ol
SMILESOC1CCC(=C2CCC(Oc3ccccc3)CC2)CC1
InChIInChI=1S/C18H24O2/c19-16-10-6-14(7-11-16)15-8-12-18(13-9-15)20-17-4-2-1-3-5-17/h1-5,16,18-19H,6-13H2/b15-14-
InChIKeyZRZZEUPZDBKHPK-PFONDFGASA-N
XLogP4.24
TPSA29.46 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500272.39
LogP ≤ 54.24
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'isolated_alkene', 'substructure': 'N/A'}

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Related Compounds

3-phenoxycyclohexan-1-ol
CID 79617811
4-phenoxypiperidin-1-ium
CID 38988695
magnesium;cyclohexyloxybenzene;hydride
CID 174438663
4-phenoxyoxane
CID 58483739
1,4-dioxaspiro[4.5]decan-8-ol;phenol;8-phenoxy-1,4-dioxaspiro[4.5]decane
CID 159456083
(4-phenoxycyclohexyl) carbamate
CID 69191754
1-cyclohexyloxy-4-phenoxybenzene
CID 70600234
4-phenoxythiane 1,1-dioxide
CID 141273372
cyclopent-3-en-1-yloxybenzene
CID 125476101
(4-phenoxycyclohexen-1-yl)oxybenzene
CID 141265703
N-methyl-4-phenoxy-N-(4-phenoxycyclohexyl)cyclohexan-1-amine
CID 155434431
3-(4-benzylphenoxy)cyclohexan-1-ol
CID 79599479

Frequently Asked Questions

What is the IUPAC name of 4-(4-phenoxycyclohexylidene)cyclohexan-1-ol?
The IUPAC name of 4-(4-phenoxycyclohexylidene)cyclohexan-1-ol (CID 67824653) is 4-(4-phenoxycyclohexylidene)cyclohexan-1-ol.
What is the SMILES notation for 4-(4-phenoxycyclohexylidene)cyclohexan-1-ol?
The canonical SMILES for 4-(4-phenoxycyclohexylidene)cyclohexan-1-ol is OC1CCC(=C2CCC(Oc3ccccc3)CC2)CC1.
What is the InChIKey of 4-(4-phenoxycyclohexylidene)cyclohexan-1-ol?
The InChIKey is ZRZZEUPZDBKHPK-PFONDFGASA-N. The full InChI is InChI=1S/C18H24O2/c19-16-10-6-14(7-11-16)15-8-12-18(13-9-15)20-17-4-2-1-3-5-17/h1-5,16,18-19H,6-13H2/b15-14-.
What are the key properties of 4-(4-phenoxycyclohexylidene)cyclohexan-1-ol?
4-(4-phenoxycyclohexylidene)cyclohexan-1-ol has a molecular weight of 272.39 g/mol, XLogP of 4.24, 2 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 4-(4-phenoxycyclohexylidene)cyclohexan-1-ol is sourced from PubChem (CID 67824653), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).