[(E)-3-(2-methylprop-2-enoxy)prop-1-enyl]cyclopropane

C10H16O — CID 102186317

IUPAC[(E)-3-(2-methylprop-2-enoxy)prop-1-enyl]cyclopropane
SMILESC=C(C)COC/C=C/C1CC1
InChIInChI=1S/C10H16O/c1-9(2)8-11-7-3-4-10-5-6-10/h3-4,10H,1,5-8H2,2H3/b4-3+
InChIKeyPOXJUKVDXITHLS-ONEGZZNKSA-N
MW152.24 g/mol
LogP2.55
Rot. Bonds5

About [(E)-3-(2-methylprop-2-enoxy)prop-1-enyl]cyclopropane

[(E)-3-(2-methylprop-2-enoxy)prop-1-enyl]cyclopropane (PubChem CID 102186317) has the molecular formula C10H16O and a molecular weight of 152.24 g/mol. Its IUPAC name is [(E)-3-(2-methylprop-2-enoxy)prop-1-enyl]cyclopropane.

Molecular Properties

Compound Name[(E)-3-(2-methylprop-2-enoxy)prop-1-enyl]cyclopropane
PubChem CID102186317
Molecular FormulaC10H16O
Molecular Weight152.24 g/mol
Exact Mass152.12
IUPAC Name[(E)-3-(2-methylprop-2-enoxy)prop-1-enyl]cyclopropane
SMILESC=C(C)COC/C=C/C1CC1
InChIInChI=1S/C10H16O/c1-9(2)8-11-7-3-4-10-5-6-10/h3-4,10H,1,5-8H2,2H3/b4-3+
InChIKeyPOXJUKVDXITHLS-ONEGZZNKSA-N
XLogP2.55
TPSA9.23 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds5
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500152.24
LogP ≤ 52.55
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

Computed Properties (RDKit)

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

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Frequently Asked Questions

What is the IUPAC name of [(E)-3-(2-methylprop-2-enoxy)prop-1-enyl]cyclopropane?
The IUPAC name of [(E)-3-(2-methylprop-2-enoxy)prop-1-enyl]cyclopropane (CID 102186317) is [(E)-3-(2-methylprop-2-enoxy)prop-1-enyl]cyclopropane.
What is the SMILES notation for [(E)-3-(2-methylprop-2-enoxy)prop-1-enyl]cyclopropane?
The canonical SMILES for [(E)-3-(2-methylprop-2-enoxy)prop-1-enyl]cyclopropane is C=C(C)COC/C=C/C1CC1.
What is the InChIKey of [(E)-3-(2-methylprop-2-enoxy)prop-1-enyl]cyclopropane?
The InChIKey is POXJUKVDXITHLS-ONEGZZNKSA-N. The full InChI is InChI=1S/C10H16O/c1-9(2)8-11-7-3-4-10-5-6-10/h3-4,10H,1,5-8H2,2H3/b4-3+.
What are the key properties of [(E)-3-(2-methylprop-2-enoxy)prop-1-enyl]cyclopropane?
[(E)-3-(2-methylprop-2-enoxy)prop-1-enyl]cyclopropane has a molecular weight of 152.24 g/mol, XLogP of 2.55, 5 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for [(E)-3-(2-methylprop-2-enoxy)prop-1-enyl]cyclopropane is sourced from PubChem (CID 102186317), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).