(3R)-3-[(E)-oct-1-enyl]cyclopenten-1-ol

C13H22O — CID 134894559

IUPAC(3R)-3-[(E)-oct-1-enyl]cyclopenten-1-ol
SMILESCCCCCC/C=C/[C@@H]1C=C(O)CC1
InChIInChI=1S/C13H22O/c1-2-3-4-5-6-7-8-12-9-10-13(14)11-12/h7-8,11-12,14H,2-6,9-10H2,1H3/b8-7+/t12-/m0/s1
InChIKeyZYEYUQIJEYVVDI-GUOLPTJISA-N
MW194.32 g/mol
LogP4.36
Rot. Bonds6

About (3R)-3-[(E)-oct-1-enyl]cyclopenten-1-ol

(3R)-3-[(E)-oct-1-enyl]cyclopenten-1-ol (PubChem CID 134894559) has the molecular formula C13H22O and a molecular weight of 194.32 g/mol. Its IUPAC name is (3R)-3-[(E)-oct-1-enyl]cyclopenten-1-ol.

Molecular Properties

Compound Name(3R)-3-[(E)-oct-1-enyl]cyclopenten-1-ol
PubChem CID134894559
Molecular FormulaC13H22O
Molecular Weight194.32 g/mol
Exact Mass194.17
IUPAC Name(3R)-3-[(E)-oct-1-enyl]cyclopenten-1-ol
SMILESCCCCCC/C=C/[C@@H]1C=C(O)CC1
InChIInChI=1S/C13H22O/c1-2-3-4-5-6-7-8-12-9-10-13(14)11-12/h7-8,11-12,14H,2-6,9-10H2,1H3/b8-7+/t12-/m0/s1
InChIKeyZYEYUQIJEYVVDI-GUOLPTJISA-N
XLogP4.36
TPSA20.23 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds6
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500194.32
LogP ≤ 54.36
H-Bond Donors ≤ 51
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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Related Compounds

cis-(1S,2R)-2-[(Z)-hept-1-enyl]cyclohexan-1-ol
CID 72704279
3-[(E)-oct-1-enyl]cyclohexene
CID 12576320
4-[(E)-hept-1-enyl]cyclopent-2-en-1-ol
CID 10921128
non-1-enylcyclopentane
CID 86065492
3-ethenyl-5-[(E)-oct-1-enyl]cyclopentene
CID 123447778
5-[(E)-non-1-enyl]cyclopenta-1,3-diene
CID 15399897
cis-(2S,3R)-2-methyl-3-[(E)-oct-1-enyl]cyclopentan-1-one
CID 11435734
(E)-hexacos-10-ene
CID 22172169
(E)-nonacos-10-ene
CID 14367300
(E)-hexadec-6-ene
CID 5352260
(Z)-docos-9-ene
CID 11690102
(Z)-tricos-11-ene
CID 5356790

Frequently Asked Questions

What is the IUPAC name of (3R)-3-[(E)-oct-1-enyl]cyclopenten-1-ol?
The IUPAC name of (3R)-3-[(E)-oct-1-enyl]cyclopenten-1-ol (CID 134894559) is (3R)-3-[(E)-oct-1-enyl]cyclopenten-1-ol.
What is the SMILES notation for (3R)-3-[(E)-oct-1-enyl]cyclopenten-1-ol?
The canonical SMILES for (3R)-3-[(E)-oct-1-enyl]cyclopenten-1-ol is CCCCCC/C=C/[C@@H]1C=C(O)CC1.
What is the InChIKey of (3R)-3-[(E)-oct-1-enyl]cyclopenten-1-ol?
The InChIKey is ZYEYUQIJEYVVDI-GUOLPTJISA-N. The full InChI is InChI=1S/C13H22O/c1-2-3-4-5-6-7-8-12-9-10-13(14)11-12/h7-8,11-12,14H,2-6,9-10H2,1H3/b8-7+/t12-/m0/s1.
What are the key properties of (3R)-3-[(E)-oct-1-enyl]cyclopenten-1-ol?
(3R)-3-[(E)-oct-1-enyl]cyclopenten-1-ol has a molecular weight of 194.32 g/mol, XLogP of 4.36, 6 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for (3R)-3-[(E)-oct-1-enyl]cyclopenten-1-ol is sourced from PubChem (CID 134894559), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).