1-(4-propan-2-ylphenyl)-5-thiophen-2-ylpentan-2-ol

C18H24OS — CID 105089080

IUPAC1-(4-propan-2-ylphenyl)-5-thiophen-2-ylpentan-2-ol
SMILESCC(C)c1ccc(CC(O)CCCc2cccs2)cc1
InChIInChI=1S/C18H24OS/c1-14(2)16-10-8-15(9-11-16)13-17(19)5-3-6-18-7-4-12-20-18/h4,7-12,14,17,19H,3,5-6,13H2,1-2H3
InChIKeyCQONPGHIJVWVLY-UHFFFAOYSA-N
MW288.46 g/mol
LogP4.80
Rot. Bonds7

About 1-(4-propan-2-ylphenyl)-5-thiophen-2-ylpentan-2-ol

1-(4-propan-2-ylphenyl)-5-thiophen-2-ylpentan-2-ol (PubChem CID 105089080) has the molecular formula C18H24OS and a molecular weight of 288.46 g/mol. Its IUPAC name is 1-(4-propan-2-ylphenyl)-5-thiophen-2-ylpentan-2-ol.

Molecular Properties

Compound Name1-(4-propan-2-ylphenyl)-5-thiophen-2-ylpentan-2-ol
PubChem CID105089080
Molecular FormulaC18H24OS
Molecular Weight288.46 g/mol
Exact Mass288.15
IUPAC Name1-(4-propan-2-ylphenyl)-5-thiophen-2-ylpentan-2-ol
SMILESCC(C)c1ccc(CC(O)CCCc2cccs2)cc1
InChIInChI=1S/C18H24OS/c1-14(2)16-10-8-15(9-11-16)13-17(19)5-3-6-18-7-4-12-20-18/h4,7-12,14,17,19H,3,5-6,13H2,1-2H3
InChIKeyCQONPGHIJVWVLY-UHFFFAOYSA-N
XLogP4.80
TPSA20.23 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds7
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500288.46
LogP ≤ 54.80
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Analyze 1-(4-propan-2-ylphenyl)-5-thiophen-2-ylpentan-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

Related Compounds

1-pyridin-4-yl-5-thiophen-2-ylpentan-2-ol
CID 66460697
1-(3,4-dichlorophenyl)-5-thiophen-2-ylpentan-2-ol
CID 63520188
1-(4-nitrophenyl)-5-thiophen-2-ylpentan-2-ol
CID 63016395
1-(4-chloro-3-fluorophenyl)-5-thiophen-2-ylpentan-2-ol
CID 107894455
1-(furan-3-yl)-5-thiophen-2-ylpentan-2-ol
CID 105123144
1-pyridin-3-yl-5-thiophen-2-ylpentan-2-ol
CID 105125071
2-methyl-6-thiophen-2-ylhexan-3-ol
CID 63774630
1-amino-5-thiophen-2-ylpentan-2-ol
CID 54294228
8-thiophen-2-yloctan-4-ol
CID 64516293
6-ethyl-1-thiophen-2-yloctan-4-ol
CID 105122585
1-(2,5-dichlorophenyl)-5-thiophen-2-ylpentan-2-ol
CID 105100465
1-(3-chloro-2-fluorophenyl)-5-thiophen-2-ylpentan-2-ol
CID 102867600

Frequently Asked Questions

What is the IUPAC name of 1-(4-propan-2-ylphenyl)-5-thiophen-2-ylpentan-2-ol?
The IUPAC name of 1-(4-propan-2-ylphenyl)-5-thiophen-2-ylpentan-2-ol (CID 105089080) is 1-(4-propan-2-ylphenyl)-5-thiophen-2-ylpentan-2-ol.
What is the SMILES notation for 1-(4-propan-2-ylphenyl)-5-thiophen-2-ylpentan-2-ol?
The canonical SMILES for 1-(4-propan-2-ylphenyl)-5-thiophen-2-ylpentan-2-ol is CC(C)c1ccc(CC(O)CCCc2cccs2)cc1.
What is the InChIKey of 1-(4-propan-2-ylphenyl)-5-thiophen-2-ylpentan-2-ol?
The InChIKey is CQONPGHIJVWVLY-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H24OS/c1-14(2)16-10-8-15(9-11-16)13-17(19)5-3-6-18-7-4-12-20-18/h4,7-12,14,17,19H,3,5-6,13H2,1-2H3.
What are the key properties of 1-(4-propan-2-ylphenyl)-5-thiophen-2-ylpentan-2-ol?
1-(4-propan-2-ylphenyl)-5-thiophen-2-ylpentan-2-ol has a molecular weight of 288.46 g/mol, XLogP of 4.80, 7 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(4-propan-2-ylphenyl)-5-thiophen-2-ylpentan-2-ol is sourced from PubChem (CID 105089080), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).