[3-(2-methylpyrazol-3-yl)thiophen-2-yl]methanol

C9H10N2OS — CID 69369524

IUPAC[3-(2-methylpyrazol-3-yl)thiophen-2-yl]methanol
SMILESCn1nccc1-c1ccsc1CO
InChIInChI=1S/C9H10N2OS/c1-11-8(2-4-10-11)7-3-5-13-9(7)6-12/h2-5,12H,6H2,1H3
InChIKeyHHPPRJDQBJCEIA-UHFFFAOYSA-N
MW194.26 g/mol
LogP1.64
Rot. Bonds2

About [3-(2-methylpyrazol-3-yl)thiophen-2-yl]methanol

[3-(2-methylpyrazol-3-yl)thiophen-2-yl]methanol (PubChem CID 69369524) has the molecular formula C9H10N2OS and a molecular weight of 194.26 g/mol. Its IUPAC name is [3-(2-methylpyrazol-3-yl)thiophen-2-yl]methanol.

Molecular Properties

Compound Name[3-(2-methylpyrazol-3-yl)thiophen-2-yl]methanol
PubChem CID69369524
Molecular FormulaC9H10N2OS
Molecular Weight194.26 g/mol
Exact Mass194.05
IUPAC Name[3-(2-methylpyrazol-3-yl)thiophen-2-yl]methanol
SMILESCn1nccc1-c1ccsc1CO
InChIInChI=1S/C9H10N2OS/c1-11-8(2-4-10-11)7-3-5-13-9(7)6-12/h2-5,12H,6H2,1H3
InChIKeyHHPPRJDQBJCEIA-UHFFFAOYSA-N
XLogP1.64
TPSA38.05 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds2
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500194.26
LogP ≤ 51.64
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of [3-(2-methylpyrazol-3-yl)thiophen-2-yl]methanol?
The IUPAC name of [3-(2-methylpyrazol-3-yl)thiophen-2-yl]methanol (CID 69369524) is [3-(2-methylpyrazol-3-yl)thiophen-2-yl]methanol.
What is the SMILES notation for [3-(2-methylpyrazol-3-yl)thiophen-2-yl]methanol?
The canonical SMILES for [3-(2-methylpyrazol-3-yl)thiophen-2-yl]methanol is Cn1nccc1-c1ccsc1CO.
What is the InChIKey of [3-(2-methylpyrazol-3-yl)thiophen-2-yl]methanol?
The InChIKey is HHPPRJDQBJCEIA-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H10N2OS/c1-11-8(2-4-10-11)7-3-5-13-9(7)6-12/h2-5,12H,6H2,1H3.
What are the key properties of [3-(2-methylpyrazol-3-yl)thiophen-2-yl]methanol?
[3-(2-methylpyrazol-3-yl)thiophen-2-yl]methanol has a molecular weight of 194.26 g/mol, XLogP of 1.64, 2 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for [3-(2-methylpyrazol-3-yl)thiophen-2-yl]methanol is sourced from PubChem (CID 69369524), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).