(E,2R)-5-(3-ethylphenyl)-2-methylpent-4-en-1-ol

C14H20O — CID 89151077

IUPAC(E,2R)-5-(3-ethylphenyl)-2-methylpent-4-en-1-ol
SMILESCCc1cccc(/C=C/C[C@@H](C)CO)c1
InChIInChI=1S/C14H20O/c1-3-13-7-5-9-14(10-13)8-4-6-12(2)11-15/h4-5,7-10,12,15H,3,6,11H2,1-2H3/b8-4+/t12-/m1/s1
InChIKeyBBNRFGIJHBZWQO-WNPFHQFXSA-N
MW204.31 g/mol
LogP3.28
Rot. Bonds5

About (E,2R)-5-(3-ethylphenyl)-2-methylpent-4-en-1-ol

(E,2R)-5-(3-ethylphenyl)-2-methylpent-4-en-1-ol (PubChem CID 89151077) has the molecular formula C14H20O and a molecular weight of 204.31 g/mol. Its IUPAC name is (E,2R)-5-(3-ethylphenyl)-2-methylpent-4-en-1-ol.

Molecular Properties

Compound Name(E,2R)-5-(3-ethylphenyl)-2-methylpent-4-en-1-ol
PubChem CID89151077
Molecular FormulaC14H20O
Molecular Weight204.31 g/mol
Exact Mass204.15
IUPAC Name(E,2R)-5-(3-ethylphenyl)-2-methylpent-4-en-1-ol
SMILESCCc1cccc(/C=C/C[C@@H](C)CO)c1
InChIInChI=1S/C14H20O/c1-3-13-7-5-9-14(10-13)8-4-6-12(2)11-15/h4-5,7-10,12,15H,3,6,11H2,1-2H3/b8-4+/t12-/m1/s1
InChIKeyBBNRFGIJHBZWQO-WNPFHQFXSA-N
XLogP3.28
TPSA20.23 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds5
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500204.31
LogP ≤ 53.28
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

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Related Compounds

(E,2S)-5-(3-ethylphenyl)pent-4-en-2-ol
CID 89151097
(2R)-2-methyl-5-(3-propan-2-ylphenyl)pent-4-en-1-ol
CID 91359945
4-(3-ethylphenyl)but-3-en-2-one
CID 174630959
(E)-4-(3-ethylphenyl)-2,2-dimethylbut-3-en-1-ol
CID 89151080
(2E,4E)-5-(3-ethylphenyl)penta-2,4-dienoic acid
CID 22003641
[3-[(E)-oct-1-enyl]phenyl]methanol
CID 11298937
3-[3-(hydroxymethyl)phenyl]prop-2-en-1-ol
CID 150777752
1-[(E)-4-methylpent-1-enyl]-3-[(E)-pent-1-enyl]benzene
CID 141236827
methyl (Z)-3-(3-ethylphenyl)prop-2-enoate
CID 97305033
1-(3-methylundecyl)-3-nonadec-1-enylbenzene
CID 173180950
3-[3-[[ethyl(propan-2-yl)amino]methyl]phenyl]prop-2-enoic acid
CID 54975079
ethane;(3-ethylphenyl)methanimine
CID 142246285

Frequently Asked Questions

What is the IUPAC name of (E,2R)-5-(3-ethylphenyl)-2-methylpent-4-en-1-ol?
The IUPAC name of (E,2R)-5-(3-ethylphenyl)-2-methylpent-4-en-1-ol (CID 89151077) is (E,2R)-5-(3-ethylphenyl)-2-methylpent-4-en-1-ol.
What is the SMILES notation for (E,2R)-5-(3-ethylphenyl)-2-methylpent-4-en-1-ol?
The canonical SMILES for (E,2R)-5-(3-ethylphenyl)-2-methylpent-4-en-1-ol is CCc1cccc(/C=C/C[C@@H](C)CO)c1.
What is the InChIKey of (E,2R)-5-(3-ethylphenyl)-2-methylpent-4-en-1-ol?
The InChIKey is BBNRFGIJHBZWQO-WNPFHQFXSA-N. The full InChI is InChI=1S/C14H20O/c1-3-13-7-5-9-14(10-13)8-4-6-12(2)11-15/h4-5,7-10,12,15H,3,6,11H2,1-2H3/b8-4+/t12-/m1/s1.
What are the key properties of (E,2R)-5-(3-ethylphenyl)-2-methylpent-4-en-1-ol?
(E,2R)-5-(3-ethylphenyl)-2-methylpent-4-en-1-ol has a molecular weight of 204.31 g/mol, XLogP of 3.28, 5 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for (E,2R)-5-(3-ethylphenyl)-2-methylpent-4-en-1-ol is sourced from PubChem (CID 89151077), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).