N-(5-ethyl-1H-pyrazol-3-yl)-2-thiophen-2-ylacetamide

C11H13N3OS — CID 104619581

IUPACN-(5-ethyl-1H-pyrazol-3-yl)-2-thiophen-2-ylacetamide
SMILESCCc1cc(NC(=O)Cc2cccs2)n[nH]1
InChIInChI=1S/C11H13N3OS/c1-2-8-6-10(14-13-8)12-11(15)7-9-4-3-5-16-9/h3-6H,2,7H2,1H3,(H2,12,13,14,15)
InChIKeyFVSAUJNEFLJAPW-UHFFFAOYSA-N
MW235.31 g/mol
LogP2.21
Rot. Bonds4

About N-(5-ethyl-1H-pyrazol-3-yl)-2-thiophen-2-ylacetamide

N-(5-ethyl-1H-pyrazol-3-yl)-2-thiophen-2-ylacetamide (PubChem CID 104619581) has the molecular formula C11H13N3OS and a molecular weight of 235.31 g/mol. Its IUPAC name is N-(5-ethyl-1H-pyrazol-3-yl)-2-thiophen-2-ylacetamide.

Molecular Properties

Compound NameN-(5-ethyl-1H-pyrazol-3-yl)-2-thiophen-2-ylacetamide
PubChem CID104619581
Molecular FormulaC11H13N3OS
Molecular Weight235.31 g/mol
Exact Mass235.08
IUPAC NameN-(5-ethyl-1H-pyrazol-3-yl)-2-thiophen-2-ylacetamide
SMILESCCc1cc(NC(=O)Cc2cccs2)n[nH]1
InChIInChI=1S/C11H13N3OS/c1-2-8-6-10(14-13-8)12-11(15)7-9-4-3-5-16-9/h3-6H,2,7H2,1H3,(H2,12,13,14,15)
InChIKeyFVSAUJNEFLJAPW-UHFFFAOYSA-N
XLogP2.21
TPSA57.78 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500235.31
LogP ≤ 52.21
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

N-(5-tert-butyl-1H-pyrazol-3-yl)-2-thiophen-2-ylacetamide
CID 104619985
N-(5-ethyl-1H-pyrazol-3-yl)-2-(2-hydroxyphenyl)acetamide
CID 113229818
N-(5-ethyl-1H-pyrazol-3-yl)-2-(1H-pyrazol-5-yl)acetamide
CID 115663310
N-(3-ethyl-2H-indazol-5-yl)-2-thiophen-2-ylacetamide
CID 123966768
N-[5-(1-ethyl-3-methylindol-2-yl)-1H-pyrazol-3-yl]-2-thiophen-2-ylacetamide
CID 53196056
2-(3,4-difluorophenyl)-N-(5-ethyl-1H-pyrazol-3-yl)acetamide
CID 112698162
N-(5-ethyl-1H-pyrazol-3-yl)-2-(3-methoxyphenyl)acetamide
CID 47423285
2-(1,2-benzoxazol-3-yl)-N-(5-ethyl-1H-pyrazol-3-yl)acetamide
CID 104619644
2-(2,3-dihydro-1H-inden-5-yl)-N-(5-ethyl-1H-pyrazol-3-yl)acetamide
CID 115593756
2-(2,4-dichlorophenyl)-N-(5-ethyl-1H-pyrazol-3-yl)acetamide
CID 47423250
N-(5-ethyl-1H-pyrazol-3-yl)-2-(2-thiophen-3-yl-1,3-thiazol-4-yl)acetamide
CID 48507454
(5-ethyl-1H-pyrazol-3-yl)urea
CID 104620406

Frequently Asked Questions

What is the IUPAC name of N-(5-ethyl-1H-pyrazol-3-yl)-2-thiophen-2-ylacetamide?
The IUPAC name of N-(5-ethyl-1H-pyrazol-3-yl)-2-thiophen-2-ylacetamide (CID 104619581) is N-(5-ethyl-1H-pyrazol-3-yl)-2-thiophen-2-ylacetamide.
What is the SMILES notation for N-(5-ethyl-1H-pyrazol-3-yl)-2-thiophen-2-ylacetamide?
The canonical SMILES for N-(5-ethyl-1H-pyrazol-3-yl)-2-thiophen-2-ylacetamide is CCc1cc(NC(=O)Cc2cccs2)n[nH]1.
What is the InChIKey of N-(5-ethyl-1H-pyrazol-3-yl)-2-thiophen-2-ylacetamide?
The InChIKey is FVSAUJNEFLJAPW-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H13N3OS/c1-2-8-6-10(14-13-8)12-11(15)7-9-4-3-5-16-9/h3-6H,2,7H2,1H3,(H2,12,13,14,15).
What are the key properties of N-(5-ethyl-1H-pyrazol-3-yl)-2-thiophen-2-ylacetamide?
N-(5-ethyl-1H-pyrazol-3-yl)-2-thiophen-2-ylacetamide has a molecular weight of 235.31 g/mol, XLogP of 2.21, 4 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-(5-ethyl-1H-pyrazol-3-yl)-2-thiophen-2-ylacetamide is sourced from PubChem (CID 104619581), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).