1-prop-2-enoxycyclopentan-1-ol

C8H14O2 — CID 57483984

IUPAC1-prop-2-enoxycyclopentan-1-ol
SMILESC=CCOC1(O)CCCC1
InChIInChI=1S/C8H14O2/c1-2-7-10-8(9)5-3-4-6-8/h2,9H,1,3-7H2
InChIKeyXMBHWMRSTCMHAJ-UHFFFAOYSA-N
MW142.20 g/mol
LogP1.45
Rot. Bonds3

About 1-prop-2-enoxycyclopentan-1-ol

1-prop-2-enoxycyclopentan-1-ol (PubChem CID 57483984) has the molecular formula C8H14O2 and a molecular weight of 142.20 g/mol. Its IUPAC name is 1-prop-2-enoxycyclopentan-1-ol.

Molecular Properties

Compound Name1-prop-2-enoxycyclopentan-1-ol
PubChem CID57483984
Molecular FormulaC8H14O2
Molecular Weight142.20 g/mol
Exact Mass142.10
IUPAC Name1-prop-2-enoxycyclopentan-1-ol
SMILESC=CCOC1(O)CCCC1
InChIInChI=1S/C8H14O2/c1-2-7-10-8(9)5-3-4-6-8/h2,9H,1,3-7H2
InChIKeyXMBHWMRSTCMHAJ-UHFFFAOYSA-N
XLogP1.45
TPSA29.46 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms10
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500142.20
LogP ≤ 51.45
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'het-C-het_not_in_ring', 'substructure': 'N/A'}, {'alert_name': 'isolated_alkene', 'substructure': 'N/A'}

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Frequently Asked Questions

What is the IUPAC name of 1-prop-2-enoxycyclopentan-1-ol?
The IUPAC name of 1-prop-2-enoxycyclopentan-1-ol (CID 57483984) is 1-prop-2-enoxycyclopentan-1-ol.
What is the SMILES notation for 1-prop-2-enoxycyclopentan-1-ol?
The canonical SMILES for 1-prop-2-enoxycyclopentan-1-ol is C=CCOC1(O)CCCC1.
What is the InChIKey of 1-prop-2-enoxycyclopentan-1-ol?
The InChIKey is XMBHWMRSTCMHAJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H14O2/c1-2-7-10-8(9)5-3-4-6-8/h2,9H,1,3-7H2.
What are the key properties of 1-prop-2-enoxycyclopentan-1-ol?
1-prop-2-enoxycyclopentan-1-ol has a molecular weight of 142.20 g/mol, XLogP of 1.45, 3 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 1-prop-2-enoxycyclopentan-1-ol is sourced from PubChem (CID 57483984), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).