[3-ethyl-4-(4-propylphenyl)phenyl]methanol

C18H22O — CID 90163510

IUPAC[3-ethyl-4-(4-propylphenyl)phenyl]methanol
SMILESCCCc1ccc(-c2ccc(CO)cc2CC)cc1
InChIInChI=1S/C18H22O/c1-3-5-14-6-9-17(10-7-14)18-11-8-15(13-19)12-16(18)4-2/h6-12,19H,3-5,13H2,1-2H3
InChIKeyNAQBPMXCSZJPQI-UHFFFAOYSA-N
MW254.37 g/mol
LogP4.36
Rot. Bonds5

About [3-ethyl-4-(4-propylphenyl)phenyl]methanol

[3-ethyl-4-(4-propylphenyl)phenyl]methanol (PubChem CID 90163510) has the molecular formula C18H22O and a molecular weight of 254.37 g/mol. Its IUPAC name is [3-ethyl-4-(4-propylphenyl)phenyl]methanol.

Molecular Properties

Compound Name[3-ethyl-4-(4-propylphenyl)phenyl]methanol
PubChem CID90163510
Molecular FormulaC18H22O
Molecular Weight254.37 g/mol
Exact Mass254.17
IUPAC Name[3-ethyl-4-(4-propylphenyl)phenyl]methanol
SMILESCCCc1ccc(-c2ccc(CO)cc2CC)cc1
InChIInChI=1S/C18H22O/c1-3-5-14-6-9-17(10-7-14)18-11-8-15(13-19)12-16(18)4-2/h6-12,19H,3-5,13H2,1-2H3
InChIKeyNAQBPMXCSZJPQI-UHFFFAOYSA-N
XLogP4.36
TPSA20.23 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds5
Heavy Atoms19
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500254.37
LogP ≤ 54.36
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

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Related Compounds

Frequently Asked Questions

What is the IUPAC name of [3-ethyl-4-(4-propylphenyl)phenyl]methanol?
The IUPAC name of [3-ethyl-4-(4-propylphenyl)phenyl]methanol (CID 90163510) is [3-ethyl-4-(4-propylphenyl)phenyl]methanol.
What is the SMILES notation for [3-ethyl-4-(4-propylphenyl)phenyl]methanol?
The canonical SMILES for [3-ethyl-4-(4-propylphenyl)phenyl]methanol is CCCc1ccc(-c2ccc(CO)cc2CC)cc1.
What is the InChIKey of [3-ethyl-4-(4-propylphenyl)phenyl]methanol?
The InChIKey is NAQBPMXCSZJPQI-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H22O/c1-3-5-14-6-9-17(10-7-14)18-11-8-15(13-19)12-16(18)4-2/h6-12,19H,3-5,13H2,1-2H3.
What are the key properties of [3-ethyl-4-(4-propylphenyl)phenyl]methanol?
[3-ethyl-4-(4-propylphenyl)phenyl]methanol has a molecular weight of 254.37 g/mol, XLogP of 4.36, 5 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for [3-ethyl-4-(4-propylphenyl)phenyl]methanol is sourced from PubChem (CID 90163510), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).