4-(5-hydroxypent-2-en-2-yloxy)pent-3-en-1-ol

C10H18O3 — CID 141072795

IUPAC4-(5-hydroxypent-2-en-2-yloxy)pent-3-en-1-ol
SMILESCC(=CCCO)OC(C)=CCCO
InChIInChI=1S/C10H18O3/c1-9(5-3-7-11)13-10(2)6-4-8-12/h5-6,11-12H,3-4,7-8H2,1-2H3
InChIKeyCNPYETVRBXTAPM-UHFFFAOYSA-N
MW186.25 g/mol
LogP1.58
Rot. Bonds6

About 4-(5-hydroxypent-2-en-2-yloxy)pent-3-en-1-ol

4-(5-hydroxypent-2-en-2-yloxy)pent-3-en-1-ol (PubChem CID 141072795) has the molecular formula C10H18O3 and a molecular weight of 186.25 g/mol. Its IUPAC name is 4-(5-hydroxypent-2-en-2-yloxy)pent-3-en-1-ol.

Molecular Properties

Compound Name4-(5-hydroxypent-2-en-2-yloxy)pent-3-en-1-ol
PubChem CID141072795
Molecular FormulaC10H18O3
Molecular Weight186.25 g/mol
Exact Mass186.13
IUPAC Name4-(5-hydroxypent-2-en-2-yloxy)pent-3-en-1-ol
SMILESCC(=CCCO)OC(C)=CCCO
InChIInChI=1S/C10H18O3/c1-9(5-3-7-11)13-10(2)6-4-8-12/h5-6,11-12H,3-4,7-8H2,1-2H3
InChIKeyCNPYETVRBXTAPM-UHFFFAOYSA-N
XLogP1.58
TPSA49.69 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds6
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500186.25
LogP ≤ 51.58
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'acyclic_C=C-O', 'substructure': 'N/A'}

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Related Compounds

(E)-2-[(E)-pentadec-2-en-2-yl]oxypentadec-2-ene
CID 90470665
5-methoxy-4-methylhex-3-en-1-ol
CID 91271839
bis[(E)-pent-2-en-2-yl] carbonate
CID 89437425
(3E,7E)-4,8-dimethyldeca-3,7-dien-1-ol
CID 22749874
(Z)-3-methylhex-3-ene-1,6-diol
CID 129322397
bis(oct-2-en-2-yl) (E)-but-2-enedioate
CID 139691536
(E)-5-hydroxy-2-methylpent-2-enenitrile
CID 14266437
[(E)-pent-2-en-2-yl] acetate
CID 12958660
(3Z)-4-methylhepta-3,6-dien-1-ol
CID 14691517
(Z)-2-methoxyhept-2-ene
CID 21160203
[(E)-oct-2-en-2-yl] prop-2-enoate
CID 50900903
(5-hydroxy-2-methylpent-2-enoyl) 2-methylhexa-2,5-dienoate
CID 173366431

Frequently Asked Questions

What is the IUPAC name of 4-(5-hydroxypent-2-en-2-yloxy)pent-3-en-1-ol?
The IUPAC name of 4-(5-hydroxypent-2-en-2-yloxy)pent-3-en-1-ol (CID 141072795) is 4-(5-hydroxypent-2-en-2-yloxy)pent-3-en-1-ol.
What is the SMILES notation for 4-(5-hydroxypent-2-en-2-yloxy)pent-3-en-1-ol?
The canonical SMILES for 4-(5-hydroxypent-2-en-2-yloxy)pent-3-en-1-ol is CC(=CCCO)OC(C)=CCCO.
What is the InChIKey of 4-(5-hydroxypent-2-en-2-yloxy)pent-3-en-1-ol?
The InChIKey is CNPYETVRBXTAPM-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H18O3/c1-9(5-3-7-11)13-10(2)6-4-8-12/h5-6,11-12H,3-4,7-8H2,1-2H3.
What are the key properties of 4-(5-hydroxypent-2-en-2-yloxy)pent-3-en-1-ol?
4-(5-hydroxypent-2-en-2-yloxy)pent-3-en-1-ol has a molecular weight of 186.25 g/mol, XLogP of 1.58, 6 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 4-(5-hydroxypent-2-en-2-yloxy)pent-3-en-1-ol is sourced from PubChem (CID 141072795), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).