(4-chlorothiophen-2-yl)methanol

C5H5ClOS — CID 67154484

IUPAC(4-chlorothiophen-2-yl)methanol
SMILESOCc1cc(Cl)cs1
InChIInChI=1S/C5H5ClOS/c6-4-1-5(2-7)8-3-4/h1,3,7H,2H2
InChIKeyZITLTSGBFHFCOG-UHFFFAOYSA-N
MW148.61 g/mol
LogP1.89
Rot. Bonds1

About (4-chlorothiophen-2-yl)methanol

(4-chlorothiophen-2-yl)methanol (PubChem CID 67154484) has the molecular formula C5H5ClOS and a molecular weight of 148.61 g/mol. Its IUPAC name is (4-chlorothiophen-2-yl)methanol.

Molecular Properties

Compound Name(4-chlorothiophen-2-yl)methanol
PubChem CID67154484
Molecular FormulaC5H5ClOS
Molecular Weight148.61 g/mol
Exact Mass147.97
IUPAC Name(4-chlorothiophen-2-yl)methanol
SMILESOCc1cc(Cl)cs1
InChIInChI=1S/C5H5ClOS/c6-4-1-5(2-7)8-3-4/h1,3,7H,2H2
InChIKeyZITLTSGBFHFCOG-UHFFFAOYSA-N
XLogP1.89
TPSA20.23 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds1
Heavy Atoms8
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500148.61
LogP ≤ 51.89
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Analyze (4-chlorothiophen-2-yl)methanol 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-Thiophenemethanol
CID 69467
1-(5-Chlorothiophen-2-yl)ethan-1-ol
CID 15361441
(5-Chlorothiophen-2-yl)methanol
CID 12554178
2-(5-Chlorothiophen-2-yl)ethan-1-ol
CID 63967770
(3,5-Dichlorothiophen-2-yl)methanol
CID 123290972
(5-Bromo-3-chlorothiophen-2-yl)methanol
CID 141388056
(S)-3-Chloro-1-(thiophen-2-yl)propan-1-ol
CID 10236042
2-Chloro-1-(thiophen-2-yl)ethan-1-ol
CID 15981657
(1S)-2-chloro-1-(thiophen-2-yl)ethan-1-ol
CID 15981658
2,2-Dichloro-1-(thiophen-2-yl)ethanol
CID 15215742
(R)-3-Chloro-1-(thiophen-2-YL)propan-1-OL
CID 10261627
3-Chloro-1-(2-thienyl)-1-propanol
CID 11658374

Frequently Asked Questions

What is the IUPAC name of (4-chlorothiophen-2-yl)methanol?
The IUPAC name of (4-chlorothiophen-2-yl)methanol (CID 67154484) is (4-chlorothiophen-2-yl)methanol.
What is the SMILES notation for (4-chlorothiophen-2-yl)methanol?
The canonical SMILES for (4-chlorothiophen-2-yl)methanol is OCc1cc(Cl)cs1.
What is the InChIKey of (4-chlorothiophen-2-yl)methanol?
The InChIKey is ZITLTSGBFHFCOG-UHFFFAOYSA-N. The full InChI is InChI=1S/C5H5ClOS/c6-4-1-5(2-7)8-3-4/h1,3,7H,2H2.
What are the key properties of (4-chlorothiophen-2-yl)methanol?
(4-chlorothiophen-2-yl)methanol has a molecular weight of 148.61 g/mol, XLogP of 1.89, 1 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for (4-chlorothiophen-2-yl)methanol is sourced from PubChem (CID 67154484), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).