N-(1-ethylpyrazol-3-yl)thiophene-3-carboxamide

C10H11N3OS — CID 53017105

IUPACN-(1-ethylpyrazol-3-yl)thiophene-3-carboxamide
SMILESCCn1ccc(NC(=O)c2ccsc2)n1
InChIInChI=1S/C10H11N3OS/c1-2-13-5-3-9(12-13)11-10(14)8-4-6-15-7-8/h3-7H,2H2,1H3,(H,11,12,14)
InChIKeyVKXOJRJWXZAHPV-UHFFFAOYSA-N
MW221.29 g/mol
LogP2.22
Rot. Bonds3

About N-(1-ethylpyrazol-3-yl)thiophene-3-carboxamide

N-(1-ethylpyrazol-3-yl)thiophene-3-carboxamide (PubChem CID 53017105) has the molecular formula C10H11N3OS and a molecular weight of 221.29 g/mol. Its IUPAC name is N-(1-ethylpyrazol-3-yl)thiophene-3-carboxamide.

Molecular Properties

Compound NameN-(1-ethylpyrazol-3-yl)thiophene-3-carboxamide
PubChem CID53017105
Molecular FormulaC10H11N3OS
Molecular Weight221.29 g/mol
Exact Mass221.06
IUPAC NameN-(1-ethylpyrazol-3-yl)thiophene-3-carboxamide
SMILESCCn1ccc(NC(=O)c2ccsc2)n1
InChIInChI=1S/C10H11N3OS/c1-2-13-5-3-9(12-13)11-10(14)8-4-6-15-7-8/h3-7H,2H2,1H3,(H,11,12,14)
InChIKeyVKXOJRJWXZAHPV-UHFFFAOYSA-N
XLogP2.22
TPSA46.92 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500221.29
LogP ≤ 52.22
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

N-(2-propylpyrazol-3-yl)thiophene-3-carboxamide
CID 38995415
N-(2-cyclopentylpyrazol-3-yl)-3-(4-oxothieno[2,3-d]pyrimidin-3-yl)propanamide
CID 40105193
N-(1-pyrazol-1-ylpropan-2-yl)thiophene-3-carboxamide
CID 43074999
N-[1-(1-methylpyrazol-3-yl)-2-oxopiperidin-3-yl]thiophene-3-carboxamide
CID 71929567
1-methyl-6-[4-(thiophene-3-carbonyl)piperazin-1-yl]-5H-pyrazolo[5,4-d]pyrimidin-4-one
CID 136263621
N-(1-cyclopentyl-1H-pyrazol-5-yl)-3-methylthiophene-2-carboxamide
CID 52472129
5-iodo-N-(1H-pyrazol-5-yl)thiophene-3-carboxamide
CID 53599815
3-methyl-N-[2-(thiophen-3-ylmethyl)pyrazol-3-yl]-1,2-thiazole-4-carboxamide
CID 75501053
N-[1-(2-fluoroethyl)pyrazol-3-yl]-2-(trifluoromethyl)thiophene-3-carboxamide
CID 138030714
N-(1-butyl-4-methyl-1H-pyrazol-5-yl)thiophene-3-carboxamide
CID 47000181
3-[3-(Thiophen-3-ylmethylamino)pyrazol-1-yl]propanamide
CID 71848000
1-methyl-N-(thiophen-3-ylmethyl)-1H-pyrazol-3-amine
CID 19626704

Frequently Asked Questions

What is the IUPAC name of N-(1-ethylpyrazol-3-yl)thiophene-3-carboxamide?
The IUPAC name of N-(1-ethylpyrazol-3-yl)thiophene-3-carboxamide (CID 53017105) is N-(1-ethylpyrazol-3-yl)thiophene-3-carboxamide.
What is the SMILES notation for N-(1-ethylpyrazol-3-yl)thiophene-3-carboxamide?
The canonical SMILES for N-(1-ethylpyrazol-3-yl)thiophene-3-carboxamide is CCn1ccc(NC(=O)c2ccsc2)n1.
What is the InChIKey of N-(1-ethylpyrazol-3-yl)thiophene-3-carboxamide?
The InChIKey is VKXOJRJWXZAHPV-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H11N3OS/c1-2-13-5-3-9(12-13)11-10(14)8-4-6-15-7-8/h3-7H,2H2,1H3,(H,11,12,14).
What are the key properties of N-(1-ethylpyrazol-3-yl)thiophene-3-carboxamide?
N-(1-ethylpyrazol-3-yl)thiophene-3-carboxamide has a molecular weight of 221.29 g/mol, XLogP of 2.22, 3 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-(1-ethylpyrazol-3-yl)thiophene-3-carboxamide is sourced from PubChem (CID 53017105), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).