3-methyl-1-(4-phenylphenyl)pentan-1-ol

C18H22O — CID 65148669

IUPAC3-methyl-1-(4-phenylphenyl)pentan-1-ol
SMILESCCC(C)CC(O)c1ccc(-c2ccccc2)cc1
InChIInChI=1S/C18H22O/c1-3-14(2)13-18(19)17-11-9-16(10-12-17)15-7-5-4-6-8-15/h4-12,14,18-19H,3,13H2,1-2H3
InChIKeyAXGIHSFJSWPRRW-UHFFFAOYSA-N
MW254.37 g/mol
LogP4.82
Rot. Bonds5

About 3-methyl-1-(4-phenylphenyl)pentan-1-ol

3-methyl-1-(4-phenylphenyl)pentan-1-ol (PubChem CID 65148669) has the molecular formula C18H22O and a molecular weight of 254.37 g/mol. Its IUPAC name is 3-methyl-1-(4-phenylphenyl)pentan-1-ol.

Molecular Properties

Compound Name3-methyl-1-(4-phenylphenyl)pentan-1-ol
PubChem CID65148669
Molecular FormulaC18H22O
Molecular Weight254.37 g/mol
Exact Mass254.17
IUPAC Name3-methyl-1-(4-phenylphenyl)pentan-1-ol
SMILESCCC(C)CC(O)c1ccc(-c2ccccc2)cc1
InChIInChI=1S/C18H22O/c1-3-14(2)13-18(19)17-11-9-16(10-12-17)15-7-5-4-6-8-15/h4-12,14,18-19H,3,13H2,1-2H3
InChIKeyAXGIHSFJSWPRRW-UHFFFAOYSA-N
XLogP4.82
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 ≤ 54.82
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

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Related Compounds

[3-methyl-1-(4-phenylphenyl)pentyl]hydrazine
CID 105310511
3-methyl-1-(4-propylphenyl)pentan-1-ol
CID 114875906
2-ethylsulfanyl-1-(4-phenylphenyl)ethanol
CID 65455892
4-[4-[1-(4-hydroxyphenyl)-3-methylpentyl]phenyl]phenol
CID 139952288
2-methylsulfanyl-1-(4-phenylphenyl)ethanol
CID 15033009
2-ethyl-1-(4-phenylphenyl)butan-1-ol
CID 63425864
1-[4-(difluoromethoxy)phenyl]-3-methylpentan-1-ol
CID 65150516
2-bromo-1-(4-phenylphenyl)ethanol
CID 13479157
(1S)-2-bromo-1-(4-phenylphenyl)ethanol
CID 13479158
4-(4-phenylphenyl)hexan-3-ol
CID 175539403
N-(5-methylheptan-3-yl)-4-phenylaniline
CID 43716868
ethane;molecular hydrogen;1-phenyl-4-propan-2-ylbenzene;propane
CID 142053065

Frequently Asked Questions

What is the IUPAC name of 3-methyl-1-(4-phenylphenyl)pentan-1-ol?
The IUPAC name of 3-methyl-1-(4-phenylphenyl)pentan-1-ol (CID 65148669) is 3-methyl-1-(4-phenylphenyl)pentan-1-ol.
What is the SMILES notation for 3-methyl-1-(4-phenylphenyl)pentan-1-ol?
The canonical SMILES for 3-methyl-1-(4-phenylphenyl)pentan-1-ol is CCC(C)CC(O)c1ccc(-c2ccccc2)cc1.
What is the InChIKey of 3-methyl-1-(4-phenylphenyl)pentan-1-ol?
The InChIKey is AXGIHSFJSWPRRW-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H22O/c1-3-14(2)13-18(19)17-11-9-16(10-12-17)15-7-5-4-6-8-15/h4-12,14,18-19H,3,13H2,1-2H3.
What are the key properties of 3-methyl-1-(4-phenylphenyl)pentan-1-ol?
3-methyl-1-(4-phenylphenyl)pentan-1-ol has a molecular weight of 254.37 g/mol, XLogP of 4.82, 5 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 3-methyl-1-(4-phenylphenyl)pentan-1-ol is sourced from PubChem (CID 65148669), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).