4-methyl-2-(2,4,6-trimethylphenyl)pentan-1-ol

C15H24O — CID 82079911

IUPAC4-methyl-2-(2,4,6-trimethylphenyl)pentan-1-ol
SMILESCc1cc(C)c(C(CO)CC(C)C)c(C)c1
InChIInChI=1S/C15H24O/c1-10(2)6-14(9-16)15-12(4)7-11(3)8-13(15)5/h7-8,10,14,16H,6,9H2,1-5H3
InChIKeyCAUUWAJRWAZNNZ-UHFFFAOYSA-N
MW220.36 g/mol
LogP3.73
Rot. Bonds4

About 4-methyl-2-(2,4,6-trimethylphenyl)pentan-1-ol

4-methyl-2-(2,4,6-trimethylphenyl)pentan-1-ol (PubChem CID 82079911) has the molecular formula C15H24O and a molecular weight of 220.36 g/mol. Its IUPAC name is 4-methyl-2-(2,4,6-trimethylphenyl)pentan-1-ol.

Molecular Properties

Compound Name4-methyl-2-(2,4,6-trimethylphenyl)pentan-1-ol
PubChem CID82079911
Molecular FormulaC15H24O
Molecular Weight220.36 g/mol
Exact Mass220.18
IUPAC Name4-methyl-2-(2,4,6-trimethylphenyl)pentan-1-ol
SMILESCc1cc(C)c(C(CO)CC(C)C)c(C)c1
InChIInChI=1S/C15H24O/c1-10(2)6-14(9-16)15-12(4)7-11(3)8-13(15)5/h7-8,10,14,16H,6,9H2,1-5H3
InChIKeyCAUUWAJRWAZNNZ-UHFFFAOYSA-N
XLogP3.73
TPSA20.23 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds4
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500220.36
LogP ≤ 53.73
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

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Related Compounds

2-(2,4,6-trimethylphenyl)propane-1,3-diol
CID 82112091
2-(2,4,6-trimethylphenyl)propan-1-ol
CID 64989562
2-(1-chloro-3-methylbutyl)-1,3,5-trimethylbenzene
CID 63431896
[3-methyl-1-(2,4,6-trimethylphenyl)butyl]hydrazine
CID 105282755
2-(4-tert-butyl-2,6-dimethylphenyl)butan-1-ol
CID 116964129
2-(2,4,6-trimethylphenyl)but-3-en-1-ol
CID 130129687
2-[1-(2,4,6-trimethylphenyl)ethylamino]butan-1-ol
CID 43207150
3-amino-2-(4-tert-butyl-2,6-dimethylphenyl)propan-1-ol
CID 82291424
4-methyl-2-(3,4,5-trifluorophenyl)pentan-1-ol
CID 143774737
2-[(2,4,6-trimethylphenyl)methylsulfanyl]propan-1-ol
CID 115659543
2-[amino-(2-methoxy-4,6-dimethylphenyl)methyl]-3-methylbutan-1-ol
CID 116945650
2-amino-5-(2,4,6-trimethylphenyl)hexan-3-ol
CID 83928281

Frequently Asked Questions

What is the IUPAC name of 4-methyl-2-(2,4,6-trimethylphenyl)pentan-1-ol?
The IUPAC name of 4-methyl-2-(2,4,6-trimethylphenyl)pentan-1-ol (CID 82079911) is 4-methyl-2-(2,4,6-trimethylphenyl)pentan-1-ol.
What is the SMILES notation for 4-methyl-2-(2,4,6-trimethylphenyl)pentan-1-ol?
The canonical SMILES for 4-methyl-2-(2,4,6-trimethylphenyl)pentan-1-ol is Cc1cc(C)c(C(CO)CC(C)C)c(C)c1.
What is the InChIKey of 4-methyl-2-(2,4,6-trimethylphenyl)pentan-1-ol?
The InChIKey is CAUUWAJRWAZNNZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H24O/c1-10(2)6-14(9-16)15-12(4)7-11(3)8-13(15)5/h7-8,10,14,16H,6,9H2,1-5H3.
What are the key properties of 4-methyl-2-(2,4,6-trimethylphenyl)pentan-1-ol?
4-methyl-2-(2,4,6-trimethylphenyl)pentan-1-ol has a molecular weight of 220.36 g/mol, XLogP of 3.73, 4 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 4-methyl-2-(2,4,6-trimethylphenyl)pentan-1-ol is sourced from PubChem (CID 82079911), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).