1-cyclohexyl-2-(2-prop-1-enylphenoxy)benzene

C21H24O — CID 175747060

IUPAC1-cyclohexyl-2-(2-prop-1-enylphenoxy)benzene
SMILESCC=Cc1ccccc1Oc1ccccc1C1CCCCC1
InChIInChI=1S/C21H24O/c1-2-10-18-13-6-8-15-20(18)22-21-16-9-7-14-19(21)17-11-4-3-5-12-17/h2,6-10,13-17H,3-5,11-12H2,1H3
InChIKeyIFXVZGAYANZCAY-UHFFFAOYSA-N
MW292.42 g/mol
LogP6.56
Rot. Bonds4

About 1-cyclohexyl-2-(2-prop-1-enylphenoxy)benzene

1-cyclohexyl-2-(2-prop-1-enylphenoxy)benzene (PubChem CID 175747060) has the molecular formula C21H24O and a molecular weight of 292.42 g/mol. Its IUPAC name is 1-cyclohexyl-2-(2-prop-1-enylphenoxy)benzene.

Molecular Properties

Compound Name1-cyclohexyl-2-(2-prop-1-enylphenoxy)benzene
PubChem CID175747060
Molecular FormulaC21H24O
Molecular Weight292.42 g/mol
Exact Mass292.18
IUPAC Name1-cyclohexyl-2-(2-prop-1-enylphenoxy)benzene
SMILESCC=Cc1ccccc1Oc1ccccc1C1CCCCC1
InChIInChI=1S/C21H24O/c1-2-10-18-13-6-8-15-20(18)22-21-16-9-7-14-19(21)17-11-4-3-5-12-17/h2,6-10,13-17H,3-5,11-12H2,1H3
InChIKeyIFXVZGAYANZCAY-UHFFFAOYSA-N
XLogP6.56
TPSA9.23 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds4
Heavy Atoms22
Complexity

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500292.42
LogP ≤ 56.56
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

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Frequently Asked Questions

What is the IUPAC name of 1-cyclohexyl-2-(2-prop-1-enylphenoxy)benzene?
The IUPAC name of 1-cyclohexyl-2-(2-prop-1-enylphenoxy)benzene (CID 175747060) is 1-cyclohexyl-2-(2-prop-1-enylphenoxy)benzene.
What is the SMILES notation for 1-cyclohexyl-2-(2-prop-1-enylphenoxy)benzene?
The canonical SMILES for 1-cyclohexyl-2-(2-prop-1-enylphenoxy)benzene is CC=Cc1ccccc1Oc1ccccc1C1CCCCC1.
What is the InChIKey of 1-cyclohexyl-2-(2-prop-1-enylphenoxy)benzene?
The InChIKey is IFXVZGAYANZCAY-UHFFFAOYSA-N. The full InChI is InChI=1S/C21H24O/c1-2-10-18-13-6-8-15-20(18)22-21-16-9-7-14-19(21)17-11-4-3-5-12-17/h2,6-10,13-17H,3-5,11-12H2,1H3.
What are the key properties of 1-cyclohexyl-2-(2-prop-1-enylphenoxy)benzene?
1-cyclohexyl-2-(2-prop-1-enylphenoxy)benzene has a molecular weight of 292.42 g/mol, XLogP of 6.56, 4 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 1-cyclohexyl-2-(2-prop-1-enylphenoxy)benzene is sourced from PubChem (CID 175747060), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).