4-methyl-4-(4-propan-2-ylphenyl)pentan-2-ol

C15H24O — CID 6366328

IUPAC4-methyl-4-(4-propan-2-ylphenyl)pentan-2-ol
SMILESCC(O)CC(C)(C)c1ccc(C(C)C)cc1
InChIInChI=1S/C15H24O/c1-11(2)13-6-8-14(9-7-13)15(4,5)10-12(3)16/h6-9,11-12,16H,10H2,1-5H3
InChIKeyFBICAHFVMKPFJF-UHFFFAOYSA-N
MW220.36 g/mol
LogP3.86
Rot. Bonds4

About 4-methyl-4-(4-propan-2-ylphenyl)pentan-2-ol

4-methyl-4-(4-propan-2-ylphenyl)pentan-2-ol (PubChem CID 6366328) has the molecular formula C15H24O and a molecular weight of 220.36 g/mol. Its IUPAC name is 4-methyl-4-(4-propan-2-ylphenyl)pentan-2-ol.

Molecular Properties

Compound Name4-methyl-4-(4-propan-2-ylphenyl)pentan-2-ol
PubChem CID6366328
Molecular FormulaC15H24O
Molecular Weight220.36 g/mol
Exact Mass220.18
IUPAC Name4-methyl-4-(4-propan-2-ylphenyl)pentan-2-ol
SMILESCC(O)CC(C)(C)c1ccc(C(C)C)cc1
InChIInChI=1S/C15H24O/c1-11(2)13-6-8-14(9-7-13)15(4,5)10-12(3)16/h6-9,11-12,16H,10H2,1-5H3
InChIKeyFBICAHFVMKPFJF-UHFFFAOYSA-N
XLogP3.86
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 ≤ 53.86
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

Analyze 4-methyl-4-(4-propan-2-ylphenyl)pentan-2-ol with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Frequently Asked Questions

What is the IUPAC name of 4-methyl-4-(4-propan-2-ylphenyl)pentan-2-ol?
The IUPAC name of 4-methyl-4-(4-propan-2-ylphenyl)pentan-2-ol (CID 6366328) is 4-methyl-4-(4-propan-2-ylphenyl)pentan-2-ol.
What is the SMILES notation for 4-methyl-4-(4-propan-2-ylphenyl)pentan-2-ol?
The canonical SMILES for 4-methyl-4-(4-propan-2-ylphenyl)pentan-2-ol is CC(O)CC(C)(C)c1ccc(C(C)C)cc1.
What is the InChIKey of 4-methyl-4-(4-propan-2-ylphenyl)pentan-2-ol?
The InChIKey is FBICAHFVMKPFJF-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H24O/c1-11(2)13-6-8-14(9-7-13)15(4,5)10-12(3)16/h6-9,11-12,16H,10H2,1-5H3.
What are the key properties of 4-methyl-4-(4-propan-2-ylphenyl)pentan-2-ol?
4-methyl-4-(4-propan-2-ylphenyl)pentan-2-ol has a molecular weight of 220.36 g/mol, XLogP of 3.86, 4 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 4-methyl-4-(4-propan-2-ylphenyl)pentan-2-ol is sourced from PubChem (CID 6366328), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).