(5-chlorothiophen-2-yl)-(2-ethylpyrazol-3-yl)methanol

C10H11ClN2OS — CID 63976751

IUPAC(5-chlorothiophen-2-yl)-(2-ethylpyrazol-3-yl)methanol
SMILESCCn1nccc1C(O)c1ccc(Cl)s1
InChIInChI=1S/C10H11ClN2OS/c1-2-13-7(5-6-12-13)10(14)8-3-4-9(11)15-8/h3-6,10,14H,2H2,1H3
InChIKeyCMDWQQBLANVFGP-UHFFFAOYSA-N
MW242.73 g/mol
LogP2.70
Rot. Bonds3

About (5-chlorothiophen-2-yl)-(2-ethylpyrazol-3-yl)methanol

(5-chlorothiophen-2-yl)-(2-ethylpyrazol-3-yl)methanol (PubChem CID 63976751) has the molecular formula C10H11ClN2OS and a molecular weight of 242.73 g/mol. Its IUPAC name is (5-chlorothiophen-2-yl)-(2-ethylpyrazol-3-yl)methanol.

Molecular Properties

Compound Name(5-chlorothiophen-2-yl)-(2-ethylpyrazol-3-yl)methanol
PubChem CID63976751
Molecular FormulaC10H11ClN2OS
Molecular Weight242.73 g/mol
Exact Mass242.03
IUPAC Name(5-chlorothiophen-2-yl)-(2-ethylpyrazol-3-yl)methanol
SMILESCCn1nccc1C(O)c1ccc(Cl)s1
InChIInChI=1S/C10H11ClN2OS/c1-2-13-7(5-6-12-13)10(14)8-3-4-9(11)15-8/h3-6,10,14H,2H2,1H3
InChIKeyCMDWQQBLANVFGP-UHFFFAOYSA-N
XLogP2.70
TPSA38.05 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500242.73
LogP ≤ 52.70
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

Analyze (5-chlorothiophen-2-yl)-(2-ethylpyrazol-3-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

Frequently Asked Questions

What is the IUPAC name of (5-chlorothiophen-2-yl)-(2-ethylpyrazol-3-yl)methanol?
The IUPAC name of (5-chlorothiophen-2-yl)-(2-ethylpyrazol-3-yl)methanol (CID 63976751) is (5-chlorothiophen-2-yl)-(2-ethylpyrazol-3-yl)methanol.
What is the SMILES notation for (5-chlorothiophen-2-yl)-(2-ethylpyrazol-3-yl)methanol?
The canonical SMILES for (5-chlorothiophen-2-yl)-(2-ethylpyrazol-3-yl)methanol is CCn1nccc1C(O)c1ccc(Cl)s1.
What is the InChIKey of (5-chlorothiophen-2-yl)-(2-ethylpyrazol-3-yl)methanol?
The InChIKey is CMDWQQBLANVFGP-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H11ClN2OS/c1-2-13-7(5-6-12-13)10(14)8-3-4-9(11)15-8/h3-6,10,14H,2H2,1H3.
What are the key properties of (5-chlorothiophen-2-yl)-(2-ethylpyrazol-3-yl)methanol?
(5-chlorothiophen-2-yl)-(2-ethylpyrazol-3-yl)methanol has a molecular weight of 242.73 g/mol, XLogP of 2.70, 3 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for (5-chlorothiophen-2-yl)-(2-ethylpyrazol-3-yl)methanol is sourced from PubChem (CID 63976751), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).