(E)-5-(4-methoxyphenyl)-2-methylpent-2-en-1-ol

C13H18O2 — CID 10420524

IUPAC(E)-5-(4-methoxyphenyl)-2-methylpent-2-en-1-ol
SMILESCOc1ccc(CC/C=C(\C)CO)cc1
InChIInChI=1S/C13H18O2/c1-11(10-14)4-3-5-12-6-8-13(15-2)9-7-12/h4,6-9,14H,3,5,10H2,1-2H3/b11-4+
InChIKeyDFGBMESZCOUNOD-NYYWCZLTSA-N
MW206.28 g/mol
LogP2.57
Rot. Bonds5

About (E)-5-(4-methoxyphenyl)-2-methylpent-2-en-1-ol

(E)-5-(4-methoxyphenyl)-2-methylpent-2-en-1-ol (PubChem CID 10420524) has the molecular formula C13H18O2 and a molecular weight of 206.28 g/mol. Its IUPAC name is (E)-5-(4-methoxyphenyl)-2-methylpent-2-en-1-ol.

Molecular Properties

Compound Name(E)-5-(4-methoxyphenyl)-2-methylpent-2-en-1-ol
PubChem CID10420524
Molecular FormulaC13H18O2
Molecular Weight206.28 g/mol
Exact Mass206.13
IUPAC Name(E)-5-(4-methoxyphenyl)-2-methylpent-2-en-1-ol
SMILESCOc1ccc(CC/C=C(\C)CO)cc1
InChIInChI=1S/C13H18O2/c1-11(10-14)4-3-5-12-6-8-13(15-2)9-7-12/h4,6-9,14H,3,5,10H2,1-2H3/b11-4+
InChIKeyDFGBMESZCOUNOD-NYYWCZLTSA-N
XLogP2.57
TPSA29.46 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds5
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500206.28
LogP ≤ 52.57
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'isolated_alkene', 'substructure': 'N/A'}

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Related Compounds

6-(4-methoxyphenyl)-4-methylhex-3-en-1-amine
CID 76997298
1-(4,4-diphenylbut-3-enyl)-4-methoxybenzene
CID 11415775
1-methoxy-4-[(E)-pent-3-enyl]benzene
CID 15169394
methyl 2-cyano-5-(4-methoxyphenyl)pent-2-enoate
CID 54078372
(4-methoxyphenyl)methanol
CID 7738
1-[(E)-6-iodohex-3-enyl]-4-methoxybenzene
CID 23455715
4-(4-methoxyphenyl)-3-methylbut-2-en-1-amine
CID 76997095
1-but-3-enyl-4-methoxybenzene
CID 164669650
(E,4R)-5-[(4-methoxyphenyl)methoxy]-2,4-dimethylpent-2-en-1-ol
CID 11010385
1-chloro-4-[4-(4-methoxyphenyl)-1-phenylbut-1-enyl]benzene
CID 71377877
3,5-bis[2-(4-methoxyphenyl)ethyl]phenol
CID 172870864
1-(4-methoxyphenyl)-5-methylhex-4-en-3-amine
CID 105004731

Frequently Asked Questions

What is the IUPAC name of (E)-5-(4-methoxyphenyl)-2-methylpent-2-en-1-ol?
The IUPAC name of (E)-5-(4-methoxyphenyl)-2-methylpent-2-en-1-ol (CID 10420524) is (E)-5-(4-methoxyphenyl)-2-methylpent-2-en-1-ol.
What is the SMILES notation for (E)-5-(4-methoxyphenyl)-2-methylpent-2-en-1-ol?
The canonical SMILES for (E)-5-(4-methoxyphenyl)-2-methylpent-2-en-1-ol is COc1ccc(CC/C=C(\C)CO)cc1.
What is the InChIKey of (E)-5-(4-methoxyphenyl)-2-methylpent-2-en-1-ol?
The InChIKey is DFGBMESZCOUNOD-NYYWCZLTSA-N. The full InChI is InChI=1S/C13H18O2/c1-11(10-14)4-3-5-12-6-8-13(15-2)9-7-12/h4,6-9,14H,3,5,10H2,1-2H3/b11-4+.
What are the key properties of (E)-5-(4-methoxyphenyl)-2-methylpent-2-en-1-ol?
(E)-5-(4-methoxyphenyl)-2-methylpent-2-en-1-ol has a molecular weight of 206.28 g/mol, XLogP of 2.57, 5 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for (E)-5-(4-methoxyphenyl)-2-methylpent-2-en-1-ol is sourced from PubChem (CID 10420524), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).