cis-(1R,2R)-1-prop-2-enoxy-1,2-bis(prop-1-en-2-yl)cyclohexane

C15H24O — CID 102073161

IUPACcis-(1R,2R)-1-prop-2-enoxy-1,2-bis(prop-1-en-2-yl)cyclohexane
SMILESC=CCO[C@]1(C(=C)C)CCCC[C@@H]1C(=C)C
InChIInChI=1S/C15H24O/c1-6-11-16-15(13(4)5)10-8-7-9-14(15)12(2)3/h6,14H,1-2,4,7-11H2,3,5H3/t14-,15+/m1/s1
InChIKeySVKWAFSXEIYIRS-CABCVRRESA-N
MW220.36 g/mol
LogP4.27
Rot. Bonds5

About cis-(1R,2R)-1-prop-2-enoxy-1,2-bis(prop-1-en-2-yl)cyclohexane

cis-(1R,2R)-1-prop-2-enoxy-1,2-bis(prop-1-en-2-yl)cyclohexane (PubChem CID 102073161) has the molecular formula C15H24O and a molecular weight of 220.36 g/mol. Its IUPAC name is cis-(1R,2R)-1-prop-2-enoxy-1,2-bis(prop-1-en-2-yl)cyclohexane.

Molecular Properties

Compound Namecis-(1R,2R)-1-prop-2-enoxy-1,2-bis(prop-1-en-2-yl)cyclohexane
PubChem CID102073161
Molecular FormulaC15H24O
Molecular Weight220.36 g/mol
Exact Mass220.18
IUPAC Namecis-(1R,2R)-1-prop-2-enoxy-1,2-bis(prop-1-en-2-yl)cyclohexane
SMILESC=CCO[C@]1(C(=C)C)CCCC[C@@H]1C(=C)C
InChIInChI=1S/C15H24O/c1-6-11-16-15(13(4)5)10-8-7-9-14(15)12(2)3/h6,14H,1-2,4,7-11H2,3,5H3/t14-,15+/m1/s1
InChIKeySVKWAFSXEIYIRS-CABCVRRESA-N
XLogP4.27
TPSA9.23 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds5
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500220.36
LogP ≤ 54.27
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

Computed Properties (RDKit)

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

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Frequently Asked Questions

What is the IUPAC name of cis-(1R,2R)-1-prop-2-enoxy-1,2-bis(prop-1-en-2-yl)cyclohexane?
The IUPAC name of cis-(1R,2R)-1-prop-2-enoxy-1,2-bis(prop-1-en-2-yl)cyclohexane (CID 102073161) is cis-(1R,2R)-1-prop-2-enoxy-1,2-bis(prop-1-en-2-yl)cyclohexane.
What is the SMILES notation for cis-(1R,2R)-1-prop-2-enoxy-1,2-bis(prop-1-en-2-yl)cyclohexane?
The canonical SMILES for cis-(1R,2R)-1-prop-2-enoxy-1,2-bis(prop-1-en-2-yl)cyclohexane is C=CCO[C@]1(C(=C)C)CCCC[C@@H]1C(=C)C.
What is the InChIKey of cis-(1R,2R)-1-prop-2-enoxy-1,2-bis(prop-1-en-2-yl)cyclohexane?
The InChIKey is SVKWAFSXEIYIRS-CABCVRRESA-N. The full InChI is InChI=1S/C15H24O/c1-6-11-16-15(13(4)5)10-8-7-9-14(15)12(2)3/h6,14H,1-2,4,7-11H2,3,5H3/t14-,15+/m1/s1.
What are the key properties of cis-(1R,2R)-1-prop-2-enoxy-1,2-bis(prop-1-en-2-yl)cyclohexane?
cis-(1R,2R)-1-prop-2-enoxy-1,2-bis(prop-1-en-2-yl)cyclohexane has a molecular weight of 220.36 g/mol, XLogP of 4.27, 5 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for cis-(1R,2R)-1-prop-2-enoxy-1,2-bis(prop-1-en-2-yl)cyclohexane is sourced from PubChem (CID 102073161), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).