N-(2-pyrazol-1-yl-2-thiophen-2-ylethyl)cyclopropanesulfonamide

C12H15N3O2S2 — CID 122265214

IUPACN-(2-pyrazol-1-yl-2-thiophen-2-ylethyl)cyclopropanesulfonamide
SMILESO=S(=O)(NCC(c1cccs1)n1cccn1)C1CC1
InChIInChI=1S/C12H15N3O2S2/c16-19(17,10-4-5-10)14-9-11(12-3-1-8-18-12)15-7-2-6-13-15/h1-3,6-8,10-11,14H,4-5,9H2
InChIKeyPJACWXPUJVREDZ-UHFFFAOYSA-N
MW297.40 g/mol
LogP1.62
Rot. Bonds6

About N-(2-pyrazol-1-yl-2-thiophen-2-ylethyl)cyclopropanesulfonamide

N-(2-pyrazol-1-yl-2-thiophen-2-ylethyl)cyclopropanesulfonamide (PubChem CID 122265214) has the molecular formula C12H15N3O2S2 and a molecular weight of 297.40 g/mol. Its IUPAC name is N-(2-pyrazol-1-yl-2-thiophen-2-ylethyl)cyclopropanesulfonamide.

Molecular Properties

Compound NameN-(2-pyrazol-1-yl-2-thiophen-2-ylethyl)cyclopropanesulfonamide
PubChem CID122265214
Molecular FormulaC12H15N3O2S2
Molecular Weight297.40 g/mol
Exact Mass297.06
IUPAC NameN-(2-pyrazol-1-yl-2-thiophen-2-ylethyl)cyclopropanesulfonamide
SMILESO=S(=O)(NCC(c1cccs1)n1cccn1)C1CC1
InChIInChI=1S/C12H15N3O2S2/c16-19(17,10-4-5-10)14-9-11(12-3-1-8-18-12)15-7-2-6-13-15/h1-3,6-8,10-11,14H,4-5,9H2
InChIKeyPJACWXPUJVREDZ-UHFFFAOYSA-N
XLogP1.62
TPSA63.99 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds6
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500297.40
LogP ≤ 51.62
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Related Compounds

N-(2-pyrazol-1-yl-2-thiophen-2-ylethyl)thiophene-2-sulfonamide
CID 122265220
N-(2-pyrazol-1-yl-2-thiophen-2-ylethyl)propane-1-sulfonamide
CID 122265215
3,3,3-trifluoro-N-(2-pyrazol-1-yl-2-thiophen-2-ylethyl)propane-1-sulfonamide
CID 122265333
2-chloro-N-(2-pyrazol-1-yl-2-thiophen-2-ylethyl)benzenesulfonamide
CID 122265246
N-(2-pyrazol-1-yl-2-thiophen-2-ylethyl)-4-(trifluoromethyl)benzenesulfonamide
CID 122265298
N-(2-pyrazol-1-yl-2-thiophen-2-ylethyl)-2,1,3-benzothiadiazole-4-sulfonamide
CID 122265336
methyl N-(2-pyrazol-1-yl-2-thiophen-2-ylethyl)carbamate
CID 122265033
N-(2-pyrazol-1-yl-2-thiophen-2-ylethyl)cyclohex-3-ene-1-carboxamide
CID 122265193
2-oxo-N-(2-pyrazol-1-yl-2-thiophen-2-ylethyl)imidazolidine-1-carboxamide
CID 119102036
N-(2-pyrazol-1-yl-2-thiophen-2-ylethyl)adamantane-1-carboxamide
CID 122265113
5-fluoro-2-methoxy-N-(2-pyrazol-1-yl-2-thiophen-2-ylethyl)benzenesulfonamide
CID 122265269
N-(2-pyrazol-1-yl-2-thiophen-2-ylethyl)butanamide
CID 122265035

Frequently Asked Questions

What is the IUPAC name of N-(2-pyrazol-1-yl-2-thiophen-2-ylethyl)cyclopropanesulfonamide?
The IUPAC name of N-(2-pyrazol-1-yl-2-thiophen-2-ylethyl)cyclopropanesulfonamide (CID 122265214) is N-(2-pyrazol-1-yl-2-thiophen-2-ylethyl)cyclopropanesulfonamide.
What is the SMILES notation for N-(2-pyrazol-1-yl-2-thiophen-2-ylethyl)cyclopropanesulfonamide?
The canonical SMILES for N-(2-pyrazol-1-yl-2-thiophen-2-ylethyl)cyclopropanesulfonamide is O=S(=O)(NCC(c1cccs1)n1cccn1)C1CC1.
What is the InChIKey of N-(2-pyrazol-1-yl-2-thiophen-2-ylethyl)cyclopropanesulfonamide?
The InChIKey is PJACWXPUJVREDZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H15N3O2S2/c16-19(17,10-4-5-10)14-9-11(12-3-1-8-18-12)15-7-2-6-13-15/h1-3,6-8,10-11,14H,4-5,9H2.
What are the key properties of N-(2-pyrazol-1-yl-2-thiophen-2-ylethyl)cyclopropanesulfonamide?
N-(2-pyrazol-1-yl-2-thiophen-2-ylethyl)cyclopropanesulfonamide has a molecular weight of 297.40 g/mol, XLogP of 1.62, 6 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2-pyrazol-1-yl-2-thiophen-2-ylethyl)cyclopropanesulfonamide is sourced from PubChem (CID 122265214), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).