1-(5-chlorothiophen-2-yl)-2-methylpropan-1-ol

C8H11ClOS — CID 61088930

IUPAC1-(5-chlorothiophen-2-yl)-2-methylpropan-1-ol
SMILESCC(C)C(O)c1ccc(Cl)s1
InChIInChI=1S/C8H11ClOS/c1-5(2)8(10)6-3-4-7(9)11-6/h3-5,8,10H,1-2H3
InChIKeyPPWZATHSNXMANM-UHFFFAOYSA-N
MW190.69 g/mol
LogP3.09
Rot. Bonds2

About 1-(5-chlorothiophen-2-yl)-2-methylpropan-1-ol

1-(5-chlorothiophen-2-yl)-2-methylpropan-1-ol (PubChem CID 61088930) has the molecular formula C8H11ClOS and a molecular weight of 190.69 g/mol. Its IUPAC name is 1-(5-chlorothiophen-2-yl)-2-methylpropan-1-ol.

Molecular Properties

Compound Name1-(5-chlorothiophen-2-yl)-2-methylpropan-1-ol
PubChem CID61088930
Molecular FormulaC8H11ClOS
Molecular Weight190.69 g/mol
Exact Mass190.02
IUPAC Name1-(5-chlorothiophen-2-yl)-2-methylpropan-1-ol
SMILESCC(C)C(O)c1ccc(Cl)s1
InChIInChI=1S/C8H11ClOS/c1-5(2)8(10)6-3-4-7(9)11-6/h3-5,8,10H,1-2H3
InChIKeyPPWZATHSNXMANM-UHFFFAOYSA-N
XLogP3.09
TPSA20.23 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500190.69
LogP ≤ 53.09
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Analyze 1-(5-chlorothiophen-2-yl)-2-methylpropan-1-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

2-methyl-1-(5-methylthiophen-2-yl)propan-1-ol
CID 61099304
2-(5-chlorothiophen-2-yl)-2-(propan-2-ylamino)ethanol
CID 82286142
2-(1-bromoethyl)-5-chlorothiophene
CID 61096745
1-(5-chlorothiophen-2-yl)-2-(methylamino)ethanol
CID 79002149
1-(5-chlorothiophen-2-yl)-N-[1-(5-chlorothiophen-2-yl)ethyl]ethanamine
CID 43692517
1-(5-chlorothiophen-2-yl)-2-ethylhexan-1-ol
CID 61087799
(1S)-2-chloro-1-(5-chlorothiophen-2-yl)ethanol
CID 83001660
2-(5-chlorothiophen-2-yl)-3-methylbutanenitrile
CID 82076378
3-(5-chlorothiophen-2-yl)butan-1-ol
CID 82075571
1-(5-chlorothiophen-2-yl)-2-(4-propan-2-ylphenyl)ethanol
CID 65150022
2-amino-5-(5-chlorothiophen-2-yl)hexan-3-ol
CID 83934933
1-(5-chlorothiophen-2-yl)-4-methoxypentan-1-ol
CID 105119672

Frequently Asked Questions

What is the IUPAC name of 1-(5-chlorothiophen-2-yl)-2-methylpropan-1-ol?
The IUPAC name of 1-(5-chlorothiophen-2-yl)-2-methylpropan-1-ol (CID 61088930) is 1-(5-chlorothiophen-2-yl)-2-methylpropan-1-ol.
What is the SMILES notation for 1-(5-chlorothiophen-2-yl)-2-methylpropan-1-ol?
The canonical SMILES for 1-(5-chlorothiophen-2-yl)-2-methylpropan-1-ol is CC(C)C(O)c1ccc(Cl)s1.
What is the InChIKey of 1-(5-chlorothiophen-2-yl)-2-methylpropan-1-ol?
The InChIKey is PPWZATHSNXMANM-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H11ClOS/c1-5(2)8(10)6-3-4-7(9)11-6/h3-5,8,10H,1-2H3.
What are the key properties of 1-(5-chlorothiophen-2-yl)-2-methylpropan-1-ol?
1-(5-chlorothiophen-2-yl)-2-methylpropan-1-ol has a molecular weight of 190.69 g/mol, XLogP of 3.09, 2 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(5-chlorothiophen-2-yl)-2-methylpropan-1-ol is sourced from PubChem (CID 61088930), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).