3-(4-methoxy-2-methylphenyl)prop-2-en-1-ol

C11H14O2 — CID 86025017

IUPAC3-(4-methoxy-2-methylphenyl)prop-2-en-1-ol
SMILESCOc1ccc(C=CCO)c(C)c1
InChIInChI=1S/C11H14O2/c1-9-8-11(13-2)6-5-10(9)4-3-7-12/h3-6,8,12H,7H2,1-2H3
InChIKeySFKQPNOKMYMHJK-UHFFFAOYSA-N
MW178.23 g/mol
LogP2.01
Rot. Bonds3

About 3-(4-methoxy-2-methylphenyl)prop-2-en-1-ol

3-(4-methoxy-2-methylphenyl)prop-2-en-1-ol (PubChem CID 86025017) has the molecular formula C11H14O2 and a molecular weight of 178.23 g/mol. Its IUPAC name is 3-(4-methoxy-2-methylphenyl)prop-2-en-1-ol.

Molecular Properties

Compound Name3-(4-methoxy-2-methylphenyl)prop-2-en-1-ol
PubChem CID86025017
Molecular FormulaC11H14O2
Molecular Weight178.23 g/mol
Exact Mass178.10
IUPAC Name3-(4-methoxy-2-methylphenyl)prop-2-en-1-ol
SMILESCOc1ccc(C=CCO)c(C)c1
InChIInChI=1S/C11H14O2/c1-9-8-11(13-2)6-5-10(9)4-3-7-12/h3-6,8,12H,7H2,1-2H3
InChIKeySFKQPNOKMYMHJK-UHFFFAOYSA-N
XLogP2.01
TPSA29.46 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500178.23
LogP ≤ 52.01
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

1-[(E)-but-1-enyl]-4-methoxy-2-methylbenzene
CID 145499218
2-(3-hydroxyprop-1-enyl)-4-methoxyphenol
CID 169453185
3-(2-bromo-5-methoxyphenyl)prop-2-en-1-ol
CID 169454365
1-[(E)-2-bromoethenyl]-4-methoxy-2-methylbenzene
CID 121395712
N-ethyl-4-(4-methoxy-2-methylphenyl)but-3-en-1-amine
CID 79589795
2-(3-hydroxyprop-1-enyl)-4-methoxybenzoic acid
CID 169453819
(E)-3-(5-methoxy-2-nitrophenyl)prop-2-en-1-ol
CID 101211674
(E)-3-(2,5-dimethoxy-4-methylphenyl)prop-2-en-1-ol
CID 10512550
3-(3,5-dimethoxyphenyl)prop-2-en-1-ol
CID 71346140
[5-methoxy-2-[(E)-pent-1-enyl]phenyl]methanol
CID 10608356
3-(4-fluoro-2-methoxyphenyl)prop-2-en-1-ol
CID 67414979
2-(4-bromobut-1-enyl)-4-methoxy-1-methylbenzene
CID 170497358

Frequently Asked Questions

What is the IUPAC name of 3-(4-methoxy-2-methylphenyl)prop-2-en-1-ol?
The IUPAC name of 3-(4-methoxy-2-methylphenyl)prop-2-en-1-ol (CID 86025017) is 3-(4-methoxy-2-methylphenyl)prop-2-en-1-ol.
What is the SMILES notation for 3-(4-methoxy-2-methylphenyl)prop-2-en-1-ol?
The canonical SMILES for 3-(4-methoxy-2-methylphenyl)prop-2-en-1-ol is COc1ccc(C=CCO)c(C)c1.
What is the InChIKey of 3-(4-methoxy-2-methylphenyl)prop-2-en-1-ol?
The InChIKey is SFKQPNOKMYMHJK-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H14O2/c1-9-8-11(13-2)6-5-10(9)4-3-7-12/h3-6,8,12H,7H2,1-2H3.
What are the key properties of 3-(4-methoxy-2-methylphenyl)prop-2-en-1-ol?
3-(4-methoxy-2-methylphenyl)prop-2-en-1-ol has a molecular weight of 178.23 g/mol, XLogP of 2.01, 3 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 3-(4-methoxy-2-methylphenyl)prop-2-en-1-ol is sourced from PubChem (CID 86025017), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).