1-(methoxymethyl)-1-[(E)-prop-1-enyl]cyclopentane

C10H18O — CID 89190138

IUPAC1-(methoxymethyl)-1-[(E)-prop-1-enyl]cyclopentane
SMILESC/C=C/C1(COC)CCCC1
InChIInChI=1S/C10H18O/c1-3-6-10(9-11-2)7-4-5-8-10/h3,6H,4-5,7-9H2,1-2H3/b6-3+
InChIKeyXBDOXOBWKPQDRJ-ZZXKWVIFSA-N
MW154.25 g/mol
LogP2.77
Rot. Bonds3

About 1-(methoxymethyl)-1-[(E)-prop-1-enyl]cyclopentane

1-(methoxymethyl)-1-[(E)-prop-1-enyl]cyclopentane (PubChem CID 89190138) has the molecular formula C10H18O and a molecular weight of 154.25 g/mol. Its IUPAC name is 1-(methoxymethyl)-1-[(E)-prop-1-enyl]cyclopentane.

Molecular Properties

Compound Name1-(methoxymethyl)-1-[(E)-prop-1-enyl]cyclopentane
PubChem CID89190138
Molecular FormulaC10H18O
Molecular Weight154.25 g/mol
Exact Mass154.14
IUPAC Name1-(methoxymethyl)-1-[(E)-prop-1-enyl]cyclopentane
SMILESC/C=C/C1(COC)CCCC1
InChIInChI=1S/C10H18O/c1-3-6-10(9-11-2)7-4-5-8-10/h3,6H,4-5,7-9H2,1-2H3/b6-3+
InChIKeyXBDOXOBWKPQDRJ-ZZXKWVIFSA-N
XLogP2.77
TPSA9.23 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds3
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500154.25
LogP ≤ 52.77
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 1-(methoxymethyl)-1-[(E)-prop-1-enyl]cyclopentane?
The IUPAC name of 1-(methoxymethyl)-1-[(E)-prop-1-enyl]cyclopentane (CID 89190138) is 1-(methoxymethyl)-1-[(E)-prop-1-enyl]cyclopentane.
What is the SMILES notation for 1-(methoxymethyl)-1-[(E)-prop-1-enyl]cyclopentane?
The canonical SMILES for 1-(methoxymethyl)-1-[(E)-prop-1-enyl]cyclopentane is C/C=C/C1(COC)CCCC1.
What is the InChIKey of 1-(methoxymethyl)-1-[(E)-prop-1-enyl]cyclopentane?
The InChIKey is XBDOXOBWKPQDRJ-ZZXKWVIFSA-N. The full InChI is InChI=1S/C10H18O/c1-3-6-10(9-11-2)7-4-5-8-10/h3,6H,4-5,7-9H2,1-2H3/b6-3+.
What are the key properties of 1-(methoxymethyl)-1-[(E)-prop-1-enyl]cyclopentane?
1-(methoxymethyl)-1-[(E)-prop-1-enyl]cyclopentane has a molecular weight of 154.25 g/mol, XLogP of 2.77, 3 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(methoxymethyl)-1-[(E)-prop-1-enyl]cyclopentane is sourced from PubChem (CID 89190138), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).