5-cyclopropyl-3-thiophen-3-yl-1H-pyrazole

C10H10N2S — CID 172892736

IUPAC5-cyclopropyl-3-thiophen-3-yl-1H-pyrazole
SMILESc1cc(-c2cc(C3CC3)[nH]n2)cs1
InChIInChI=1S/C10H10N2S/c1-2-7(1)9-5-10(12-11-9)8-3-4-13-6-8/h3-7H,1-2H2,(H,11,12)
InChIKeyLSZIIRPTRIVKFY-UHFFFAOYSA-N
MW190.27 g/mol
LogP3.02
Rot. Bonds2

About 5-cyclopropyl-3-thiophen-3-yl-1H-pyrazole

5-cyclopropyl-3-thiophen-3-yl-1H-pyrazole (PubChem CID 172892736) has the molecular formula C10H10N2S and a molecular weight of 190.27 g/mol. Its IUPAC name is 5-cyclopropyl-3-thiophen-3-yl-1H-pyrazole.

Molecular Properties

Compound Name5-cyclopropyl-3-thiophen-3-yl-1H-pyrazole
PubChem CID172892736
Molecular FormulaC10H10N2S
Molecular Weight190.27 g/mol
Exact Mass190.06
IUPAC Name5-cyclopropyl-3-thiophen-3-yl-1H-pyrazole
SMILESc1cc(-c2cc(C3CC3)[nH]n2)cs1
InChIInChI=1S/C10H10N2S/c1-2-7(1)9-5-10(12-11-9)8-3-4-13-6-8/h3-7H,1-2H2,(H,11,12)
InChIKeyLSZIIRPTRIVKFY-UHFFFAOYSA-N
XLogP3.02
TPSA28.68 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500190.27
LogP ≤ 53.02
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 5-cyclopropyl-3-thiophen-3-yl-1H-pyrazole?
The IUPAC name of 5-cyclopropyl-3-thiophen-3-yl-1H-pyrazole (CID 172892736) is 5-cyclopropyl-3-thiophen-3-yl-1H-pyrazole.
What is the SMILES notation for 5-cyclopropyl-3-thiophen-3-yl-1H-pyrazole?
The canonical SMILES for 5-cyclopropyl-3-thiophen-3-yl-1H-pyrazole is c1cc(-c2cc(C3CC3)[nH]n2)cs1.
What is the InChIKey of 5-cyclopropyl-3-thiophen-3-yl-1H-pyrazole?
The InChIKey is LSZIIRPTRIVKFY-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H10N2S/c1-2-7(1)9-5-10(12-11-9)8-3-4-13-6-8/h3-7H,1-2H2,(H,11,12).
What are the key properties of 5-cyclopropyl-3-thiophen-3-yl-1H-pyrazole?
5-cyclopropyl-3-thiophen-3-yl-1H-pyrazole has a molecular weight of 190.27 g/mol, XLogP of 3.02, 2 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 5-cyclopropyl-3-thiophen-3-yl-1H-pyrazole is sourced from PubChem (CID 172892736), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).