(E)-2-methyl-5-(4-methylphenyl)pent-4-en-2-ol

C13H18O — CID 177408870

IUPAC(E)-2-methyl-5-(4-methylphenyl)pent-4-en-2-ol
SMILESCc1ccc(/C=C/CC(C)(C)O)cc1
InChIInChI=1S/C13H18O/c1-11-6-8-12(9-7-11)5-4-10-13(2,3)14/h4-9,14H,10H2,1-3H3/b5-4+
InChIKeyMSAUEBFWUWMWTI-SNAWJCMRSA-N
MW190.29 g/mol
LogP3.17
Rot. Bonds3

About (E)-2-methyl-5-(4-methylphenyl)pent-4-en-2-ol

(E)-2-methyl-5-(4-methylphenyl)pent-4-en-2-ol (PubChem CID 177408870) has the molecular formula C13H18O and a molecular weight of 190.29 g/mol. Its IUPAC name is (E)-2-methyl-5-(4-methylphenyl)pent-4-en-2-ol.

Molecular Properties

Compound Name(E)-2-methyl-5-(4-methylphenyl)pent-4-en-2-ol
PubChem CID177408870
Molecular FormulaC13H18O
Molecular Weight190.29 g/mol
Exact Mass190.14
IUPAC Name(E)-2-methyl-5-(4-methylphenyl)pent-4-en-2-ol
SMILESCc1ccc(/C=C/CC(C)(C)O)cc1
InChIInChI=1S/C13H18O/c1-11-6-8-12(9-7-11)5-4-10-13(2,3)14/h4-9,14H,10H2,1-3H3/b5-4+
InChIKeyMSAUEBFWUWMWTI-SNAWJCMRSA-N
XLogP3.17
TPSA20.23 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds3
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500190.29
LogP ≤ 53.17
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

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Related Compounds

(Z)-4-(4-methylphenyl)but-3-enoic acid
CID 94034249
ethane;1-methyl-4-[2-(4-methylphenyl)ethenyl]benzene
CID 91206086
ethane;1-methyl-4-[2-(4-methylphenyl)ethenyl]benzene
CID 90770914
4-(4-methylphenyl)but-3-ene-1-thiol
CID 170477722
(E)-6-(4-methylphenyl)hex-5-en-1-ol
CID 14739740
1-methyl-4-[4-[3-[4-[4-(4-methylphenyl)phenyl]phenyl]prop-2-enyl]phenyl]benzene
CID 161223242
5-(4-methylphenyl)pent-4-enal
CID 85344490
1-methyl-4-[(E)-3-[(E)-3,3,3-trifluoroprop-1-enoxy]prop-1-enyl]benzene
CID 71569630
1-[(E)-but-1-enyl]-4-[(Z)-1,2-difluoro-2-(4-methylphenyl)ethenyl]benzene
CID 139748692
1-methyl-4-[(4Z,6Z)-octa-1,4,6-trienyl]benzene
CID 145008709
5-(4-methylphenyl)pent-4-enenitrile
CID 174636399
2-hydroxypropan-2-yl (E)-3-(4-methylphenyl)prop-2-enoate
CID 141366675

Frequently Asked Questions

What is the IUPAC name of (E)-2-methyl-5-(4-methylphenyl)pent-4-en-2-ol?
The IUPAC name of (E)-2-methyl-5-(4-methylphenyl)pent-4-en-2-ol (CID 177408870) is (E)-2-methyl-5-(4-methylphenyl)pent-4-en-2-ol.
What is the SMILES notation for (E)-2-methyl-5-(4-methylphenyl)pent-4-en-2-ol?
The canonical SMILES for (E)-2-methyl-5-(4-methylphenyl)pent-4-en-2-ol is Cc1ccc(/C=C/CC(C)(C)O)cc1.
What is the InChIKey of (E)-2-methyl-5-(4-methylphenyl)pent-4-en-2-ol?
The InChIKey is MSAUEBFWUWMWTI-SNAWJCMRSA-N. The full InChI is InChI=1S/C13H18O/c1-11-6-8-12(9-7-11)5-4-10-13(2,3)14/h4-9,14H,10H2,1-3H3/b5-4+.
What are the key properties of (E)-2-methyl-5-(4-methylphenyl)pent-4-en-2-ol?
(E)-2-methyl-5-(4-methylphenyl)pent-4-en-2-ol has a molecular weight of 190.29 g/mol, XLogP of 3.17, 3 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for (E)-2-methyl-5-(4-methylphenyl)pent-4-en-2-ol is sourced from PubChem (CID 177408870), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).