(E)-4-methoxy-3-methyl-2-methylidenepent-3-en-1-ol

C8H14O2 — CID 89424137

IUPAC(E)-4-methoxy-3-methyl-2-methylidenepent-3-en-1-ol
SMILESC=C(CO)/C(C)=C(\C)OC
InChIInChI=1S/C8H14O2/c1-6(5-9)7(2)8(3)10-4/h9H,1,5H2,2-4H3/b8-7+
InChIKeyLWQQFWLZZPXJAP-BQYQJAHWSA-N
MW142.20 g/mol
LogP1.48
Rot. Bonds3

About (E)-4-methoxy-3-methyl-2-methylidenepent-3-en-1-ol

(E)-4-methoxy-3-methyl-2-methylidenepent-3-en-1-ol (PubChem CID 89424137) has the molecular formula C8H14O2 and a molecular weight of 142.20 g/mol. Its IUPAC name is (E)-4-methoxy-3-methyl-2-methylidenepent-3-en-1-ol.

Molecular Properties

Compound Name(E)-4-methoxy-3-methyl-2-methylidenepent-3-en-1-ol
PubChem CID89424137
Molecular FormulaC8H14O2
Molecular Weight142.20 g/mol
Exact Mass142.10
IUPAC Name(E)-4-methoxy-3-methyl-2-methylidenepent-3-en-1-ol
SMILESC=C(CO)/C(C)=C(\C)OC
InChIInChI=1S/C8H14O2/c1-6(5-9)7(2)8(3)10-4/h9H,1,5H2,2-4H3/b8-7+
InChIKeyLWQQFWLZZPXJAP-BQYQJAHWSA-N
XLogP1.48
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 ≤ 51.48
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

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

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Related Compounds

[(Z)-1-hydroxy-3-methoxy-2-methylbut-2-enylidene]chromium
CID 10984817
(E)-3-methoxy-2-methylbut-2-enamide
CID 55284643
2-methylprop-2-en-1-ol;zirconium
CID 88651592
(3E)-3-fluoro-2-methoxy-5-methylhexa-1,3,5-triene;propane
CID 143383116
2-methylprop-2-en-1-ol;oxirane
CID 87800539
fluoromethane;2-methoxyprop-1-ene
CID 143721713
methyl 2-methylidenebutanoate;propan-2-one
CID 174771904
methyl 4-methyl-3-methylidenepent-4-enoate
CID 89146578
ethane;(Z)-2-methoxy-3-methylpent-2-ene
CID 144825663
(3Z)-2-methoxy-4-(1-methoxyethenyl)hepta-1,3-diene
CID 142585808
(E)-2-fluoro-3-methoxybut-2-ene
CID 163586290
tetrakis(ethane-1,2-diol);2-methylprop-1-ene
CID 173101980

Frequently Asked Questions

What is the IUPAC name of (E)-4-methoxy-3-methyl-2-methylidenepent-3-en-1-ol?
The IUPAC name of (E)-4-methoxy-3-methyl-2-methylidenepent-3-en-1-ol (CID 89424137) is (E)-4-methoxy-3-methyl-2-methylidenepent-3-en-1-ol.
What is the SMILES notation for (E)-4-methoxy-3-methyl-2-methylidenepent-3-en-1-ol?
The canonical SMILES for (E)-4-methoxy-3-methyl-2-methylidenepent-3-en-1-ol is C=C(CO)/C(C)=C(\C)OC.
What is the InChIKey of (E)-4-methoxy-3-methyl-2-methylidenepent-3-en-1-ol?
The InChIKey is LWQQFWLZZPXJAP-BQYQJAHWSA-N. The full InChI is InChI=1S/C8H14O2/c1-6(5-9)7(2)8(3)10-4/h9H,1,5H2,2-4H3/b8-7+.
What are the key properties of (E)-4-methoxy-3-methyl-2-methylidenepent-3-en-1-ol?
(E)-4-methoxy-3-methyl-2-methylidenepent-3-en-1-ol has a molecular weight of 142.20 g/mol, XLogP of 1.48, 3 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for (E)-4-methoxy-3-methyl-2-methylidenepent-3-en-1-ol is sourced from PubChem (CID 89424137), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).