(Z)-5-methoxypent-3-en-1-ol

C6H12O2 — CID 10240796

IUPAC(Z)-5-methoxypent-3-en-1-ol
SMILESCOC/C=C\CCO
InChIInChI=1S/C6H12O2/c1-8-6-4-2-3-5-7/h2,4,7H,3,5-6H2,1H3/b4-2-
InChIKeyNWCPRNWUZBCAFQ-RQOWECAXSA-N
MW116.16 g/mol
LogP0.57
Rot. Bonds4

About (Z)-5-methoxypent-3-en-1-ol

(Z)-5-methoxypent-3-en-1-ol (PubChem CID 10240796) has the molecular formula C6H12O2 and a molecular weight of 116.16 g/mol. Its IUPAC name is (Z)-5-methoxypent-3-en-1-ol.

Molecular Properties

Compound Name(Z)-5-methoxypent-3-en-1-ol
PubChem CID10240796
Molecular FormulaC6H12O2
Molecular Weight116.16 g/mol
Exact Mass116.08
IUPAC Name(Z)-5-methoxypent-3-en-1-ol
SMILESCOC/C=C\CCO
InChIInChI=1S/C6H12O2/c1-8-6-4-2-3-5-7/h2,4,7H,3,5-6H2,1H3/b4-2-
InChIKeyNWCPRNWUZBCAFQ-RQOWECAXSA-N
XLogP0.57
TPSA29.46 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms8
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500116.16
LogP ≤ 50.57
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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 (Z)-5-methoxypent-3-en-1-ol?
The IUPAC name of (Z)-5-methoxypent-3-en-1-ol (CID 10240796) is (Z)-5-methoxypent-3-en-1-ol.
What is the SMILES notation for (Z)-5-methoxypent-3-en-1-ol?
The canonical SMILES for (Z)-5-methoxypent-3-en-1-ol is COC/C=C\CCO.
What is the InChIKey of (Z)-5-methoxypent-3-en-1-ol?
The InChIKey is NWCPRNWUZBCAFQ-RQOWECAXSA-N. The full InChI is InChI=1S/C6H12O2/c1-8-6-4-2-3-5-7/h2,4,7H,3,5-6H2,1H3/b4-2-.
What are the key properties of (Z)-5-methoxypent-3-en-1-ol?
(Z)-5-methoxypent-3-en-1-ol has a molecular weight of 116.16 g/mol, XLogP of 0.57, 4 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for (Z)-5-methoxypent-3-en-1-ol is sourced from PubChem (CID 10240796), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).