(5-ethylthiophen-2-yl)-(2-methylpyrazol-3-yl)methanol

C11H14N2OS — CID 63960734

IUPAC(5-ethylthiophen-2-yl)-(2-methylpyrazol-3-yl)methanol
SMILESCCc1ccc(C(O)c2ccnn2C)s1
InChIInChI=1S/C11H14N2OS/c1-3-8-4-5-10(15-8)11(14)9-6-7-12-13(9)2/h4-7,11,14H,3H2,1-2H3
InChIKeyZJLKIXSFLVFUJM-UHFFFAOYSA-N
MW222.31 g/mol
LogP2.13
Rot. Bonds3

About (5-ethylthiophen-2-yl)-(2-methylpyrazol-3-yl)methanol

(5-ethylthiophen-2-yl)-(2-methylpyrazol-3-yl)methanol (PubChem CID 63960734) has the molecular formula C11H14N2OS and a molecular weight of 222.31 g/mol. Its IUPAC name is (5-ethylthiophen-2-yl)-(2-methylpyrazol-3-yl)methanol.

Molecular Properties

Compound Name(5-ethylthiophen-2-yl)-(2-methylpyrazol-3-yl)methanol
PubChem CID63960734
Molecular FormulaC11H14N2OS
Molecular Weight222.31 g/mol
Exact Mass222.08
IUPAC Name(5-ethylthiophen-2-yl)-(2-methylpyrazol-3-yl)methanol
SMILESCCc1ccc(C(O)c2ccnn2C)s1
InChIInChI=1S/C11H14N2OS/c1-3-8-4-5-10(15-8)11(14)9-6-7-12-13(9)2/h4-7,11,14H,3H2,1-2H3
InChIKeyZJLKIXSFLVFUJM-UHFFFAOYSA-N
XLogP2.13
TPSA38.05 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500222.31
LogP ≤ 52.13
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

Analyze (5-ethylthiophen-2-yl)-(2-methylpyrazol-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-ethylthiophen-2-yl)-(2-methylpyrazol-3-yl)methanol?
The IUPAC name of (5-ethylthiophen-2-yl)-(2-methylpyrazol-3-yl)methanol (CID 63960734) is (5-ethylthiophen-2-yl)-(2-methylpyrazol-3-yl)methanol.
What is the SMILES notation for (5-ethylthiophen-2-yl)-(2-methylpyrazol-3-yl)methanol?
The canonical SMILES for (5-ethylthiophen-2-yl)-(2-methylpyrazol-3-yl)methanol is CCc1ccc(C(O)c2ccnn2C)s1.
What is the InChIKey of (5-ethylthiophen-2-yl)-(2-methylpyrazol-3-yl)methanol?
The InChIKey is ZJLKIXSFLVFUJM-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H14N2OS/c1-3-8-4-5-10(15-8)11(14)9-6-7-12-13(9)2/h4-7,11,14H,3H2,1-2H3.
What are the key properties of (5-ethylthiophen-2-yl)-(2-methylpyrazol-3-yl)methanol?
(5-ethylthiophen-2-yl)-(2-methylpyrazol-3-yl)methanol has a molecular weight of 222.31 g/mol, XLogP of 2.13, 3 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for (5-ethylthiophen-2-yl)-(2-methylpyrazol-3-yl)methanol is sourced from PubChem (CID 63960734), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).