N-[1-[5-[ethyl-[(1-methylpyrazol-4-yl)methyl]sulfamoyl]thiophen-2-yl]ethyl]acetamide

C15H22N4O3S2 — CID 47083099

IUPACN-[1-[5-[ethyl-[(1-methylpyrazol-4-yl)methyl]sulfamoyl]thiophen-2-yl]ethyl]acetamide
SMILESCCN(Cc1cnn(C)c1)S(=O)(=O)c1ccc(C(C)NC(C)=O)s1
InChIInChI=1S/C15H22N4O3S2/c1-5-19(10-13-8-16-18(4)9-13)24(21,22)15-7-6-14(23-15)11(2)17-12(3)20/h6-9,11H,5,10H2,1-4H3,(H,17,20)
InChIKeyJXFWOVKPWBYSPK-UHFFFAOYSA-N
MW370.50 g/mol
LogP1.89
Rot. Bonds7

About N-[1-[5-[ethyl-[(1-methylpyrazol-4-yl)methyl]sulfamoyl]thiophen-2-yl]ethyl]acetamide

N-[1-[5-[ethyl-[(1-methylpyrazol-4-yl)methyl]sulfamoyl]thiophen-2-yl]ethyl]acetamide (PubChem CID 47083099) has the molecular formula C15H22N4O3S2 and a molecular weight of 370.50 g/mol. Its IUPAC name is N-[1-[5-[ethyl-[(1-methylpyrazol-4-yl)methyl]sulfamoyl]thiophen-2-yl]ethyl]acetamide.

Molecular Properties

Compound NameN-[1-[5-[ethyl-[(1-methylpyrazol-4-yl)methyl]sulfamoyl]thiophen-2-yl]ethyl]acetamide
PubChem CID47083099
Molecular FormulaC15H22N4O3S2
Molecular Weight370.50 g/mol
Exact Mass370.11
IUPAC NameN-[1-[5-[ethyl-[(1-methylpyrazol-4-yl)methyl]sulfamoyl]thiophen-2-yl]ethyl]acetamide
SMILESCCN(Cc1cnn(C)c1)S(=O)(=O)c1ccc(C(C)NC(C)=O)s1
InChIInChI=1S/C15H22N4O3S2/c1-5-19(10-13-8-16-18(4)9-13)24(21,22)15-7-6-14(23-15)11(2)17-12(3)20/h6-9,11H,5,10H2,1-4H3,(H,17,20)
InChIKeyJXFWOVKPWBYSPK-UHFFFAOYSA-N
XLogP1.89
TPSA84.30 Ų
H-Bond Donors1
H-Bond Acceptors6
Rotatable Bonds7
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500370.50
LogP ≤ 51.89
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 106

Analyze N-[1-[5-[ethyl-[(1-methylpyrazol-4-yl)methyl]sulfamoyl]thiophen-2-yl]ethyl]acetamide with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

N-[3-[ethyl-[(1-methylpyrazol-4-yl)methyl]sulfamoyl]-4-methoxyphenyl]acetamide
CID 47813010
N-ethyl-N-[(1-methylpyrazol-4-yl)methyl]-4-methylsulfonylbenzenesulfonamide
CID 47812984
1-methyl-N-[1-(5-sulfamoylthiophen-2-yl)ethyl]pyrazole-4-carboxamide
CID 43246483
5-bromo-N-methyl-N-[(1-methylpyrazol-4-yl)methyl]thiophene-2-sulfonamide
CID 22771399
6-chloro-N-ethyl-N-[(1-methylpyrazol-4-yl)methyl]pyridine-3-sulfonamide
CID 47400652
N-ethyl-2,4-difluoro-N-[(1-methylpyrazol-4-yl)methyl]benzenesulfonamide
CID 52783463
4-cyclohexyl-N-ethyl-N-[(1-methylpyrazol-4-yl)methyl]benzenesulfonamide
CID 52753328
1-methyl-1-[(1-methylpyrazol-4-yl)methyl]-3-[(1R)-2-methyl-1-thiophen-2-ylpropyl]urea
CID 95129803
2-(1-methylpyrazol-4-yl)-N-propan-2-ylacetamide
CID 130716283
3-[1-(2-methoxyphenyl)ethyl]-1-methyl-1-[(1-methylpyrazol-4-yl)methyl]urea
CID 75459929
3-[1-(4-ethylsulfanylphenyl)ethyl]-1-methyl-1-[(1-methylpyrazol-4-yl)methyl]urea
CID 56825761
1-ethyl-3-[(1R)-1-[1-(2-methoxyphenyl)pyrazol-4-yl]ethyl]-1-[(1-methylpyrazol-4-yl)methyl]urea
CID 125444856

Frequently Asked Questions

What is the IUPAC name of N-[1-[5-[ethyl-[(1-methylpyrazol-4-yl)methyl]sulfamoyl]thiophen-2-yl]ethyl]acetamide?
The IUPAC name of N-[1-[5-[ethyl-[(1-methylpyrazol-4-yl)methyl]sulfamoyl]thiophen-2-yl]ethyl]acetamide (CID 47083099) is N-[1-[5-[ethyl-[(1-methylpyrazol-4-yl)methyl]sulfamoyl]thiophen-2-yl]ethyl]acetamide.
What is the SMILES notation for N-[1-[5-[ethyl-[(1-methylpyrazol-4-yl)methyl]sulfamoyl]thiophen-2-yl]ethyl]acetamide?
The canonical SMILES for N-[1-[5-[ethyl-[(1-methylpyrazol-4-yl)methyl]sulfamoyl]thiophen-2-yl]ethyl]acetamide is CCN(Cc1cnn(C)c1)S(=O)(=O)c1ccc(C(C)NC(C)=O)s1.
What is the InChIKey of N-[1-[5-[ethyl-[(1-methylpyrazol-4-yl)methyl]sulfamoyl]thiophen-2-yl]ethyl]acetamide?
The InChIKey is JXFWOVKPWBYSPK-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H22N4O3S2/c1-5-19(10-13-8-16-18(4)9-13)24(21,22)15-7-6-14(23-15)11(2)17-12(3)20/h6-9,11H,5,10H2,1-4H3,(H,17,20).
What are the key properties of N-[1-[5-[ethyl-[(1-methylpyrazol-4-yl)methyl]sulfamoyl]thiophen-2-yl]ethyl]acetamide?
N-[1-[5-[ethyl-[(1-methylpyrazol-4-yl)methyl]sulfamoyl]thiophen-2-yl]ethyl]acetamide has a molecular weight of 370.50 g/mol, XLogP of 1.89, 7 rotatable bonds, 1 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for N-[1-[5-[ethyl-[(1-methylpyrazol-4-yl)methyl]sulfamoyl]thiophen-2-yl]ethyl]acetamide is sourced from PubChem (CID 47083099), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).