3-methyl-1-[(2,4,6-trimethylphenyl)methyl]cyclopentan-1-ol

C16H24O — CID 64514526

IUPAC3-methyl-1-[(2,4,6-trimethylphenyl)methyl]cyclopentan-1-ol
SMILESCc1cc(C)c(CC2(O)CCC(C)C2)c(C)c1
InChIInChI=1S/C16H24O/c1-11-5-6-16(17,9-11)10-15-13(3)7-12(2)8-14(15)4/h7-8,11,17H,5-6,9-10H2,1-4H3
InChIKeyHZHWHHMIOJJDPK-UHFFFAOYSA-N
MW232.37 g/mol
LogP3.71
Rot. Bonds2

About 3-methyl-1-[(2,4,6-trimethylphenyl)methyl]cyclopentan-1-ol

3-methyl-1-[(2,4,6-trimethylphenyl)methyl]cyclopentan-1-ol (PubChem CID 64514526) has the molecular formula C16H24O and a molecular weight of 232.37 g/mol. Its IUPAC name is 3-methyl-1-[(2,4,6-trimethylphenyl)methyl]cyclopentan-1-ol.

Molecular Properties

Compound Name3-methyl-1-[(2,4,6-trimethylphenyl)methyl]cyclopentan-1-ol
PubChem CID64514526
Molecular FormulaC16H24O
Molecular Weight232.37 g/mol
Exact Mass232.18
IUPAC Name3-methyl-1-[(2,4,6-trimethylphenyl)methyl]cyclopentan-1-ol
SMILESCc1cc(C)c(CC2(O)CCC(C)C2)c(C)c1
InChIInChI=1S/C16H24O/c1-11-5-6-16(17,9-11)10-15-13(3)7-12(2)8-14(15)4/h7-8,11,17H,5-6,9-10H2,1-4H3
InChIKeyHZHWHHMIOJJDPK-UHFFFAOYSA-N
XLogP3.71
TPSA20.23 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds2
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500232.37
LogP ≤ 53.71
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

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Related Compounds

3-methyl-1-[(2,4,6-trimethylphenyl)methyl]cyclopentan-1-amine
CID 64513860
3-methyl-1-[[(2,4,6-trimethylphenyl)methylamino]methyl]cyclohexan-1-ol
CID 63934761
[3-methyl-1-[(2,4,6-trimethylphenyl)methyl]cyclopentyl]methanamine
CID 65403094
4-methyl-1-[(2,4,6-trimethylphenyl)methyl]cyclohexane-1-carboxylic acid
CID 65395327
3-propan-2-yl-1-[(2,4,6-trimethylphenyl)methyl]cyclobutan-1-ol
CID 103564047
1-[(4-fluoro-2-methylphenyl)methyl]-3-methylcyclopentan-1-ol
CID 114346880
1-methyl-4-[(2,4,6-trimethylphenyl)methyl]piperidin-4-ol
CID 62550581
N-[(1-hydroxy-4-methylcyclohexyl)methyl]-2,4,6-trimethylbenzamide
CID 65120092
2,4,4-trimethyl-1-[(2,4,6-trimethylphenyl)methyl]cyclopentan-1-ol
CID 106663682
1-methyl-3-[(2,4,6-trimethylphenyl)methyl]pyrrolidin-3-ol
CID 62977084
1-[(2,5-dimethylphenyl)methyl]-4-methylcyclohexan-1-ol
CID 54958001
1-[(5-bromo-2-fluorophenyl)methyl]-3-methylcyclopentan-1-ol
CID 65153621

Frequently Asked Questions

What is the IUPAC name of 3-methyl-1-[(2,4,6-trimethylphenyl)methyl]cyclopentan-1-ol?
The IUPAC name of 3-methyl-1-[(2,4,6-trimethylphenyl)methyl]cyclopentan-1-ol (CID 64514526) is 3-methyl-1-[(2,4,6-trimethylphenyl)methyl]cyclopentan-1-ol.
What is the SMILES notation for 3-methyl-1-[(2,4,6-trimethylphenyl)methyl]cyclopentan-1-ol?
The canonical SMILES for 3-methyl-1-[(2,4,6-trimethylphenyl)methyl]cyclopentan-1-ol is Cc1cc(C)c(CC2(O)CCC(C)C2)c(C)c1.
What is the InChIKey of 3-methyl-1-[(2,4,6-trimethylphenyl)methyl]cyclopentan-1-ol?
The InChIKey is HZHWHHMIOJJDPK-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H24O/c1-11-5-6-16(17,9-11)10-15-13(3)7-12(2)8-14(15)4/h7-8,11,17H,5-6,9-10H2,1-4H3.
What are the key properties of 3-methyl-1-[(2,4,6-trimethylphenyl)methyl]cyclopentan-1-ol?
3-methyl-1-[(2,4,6-trimethylphenyl)methyl]cyclopentan-1-ol has a molecular weight of 232.37 g/mol, XLogP of 3.71, 2 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 3-methyl-1-[(2,4,6-trimethylphenyl)methyl]cyclopentan-1-ol is sourced from PubChem (CID 64514526), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).