N-cyclohexyl-2-methyl-5-(4-propan-2-yl-1,3-thiazol-2-yl)thiophene-3-sulfonamide

C17H24N2O2S3 — CID 50835214

IUPACN-cyclohexyl-2-methyl-5-(4-propan-2-yl-1,3-thiazol-2-yl)thiophene-3-sulfonamide
SMILESCc1sc(-c2nc(C(C)C)cs2)cc1S(=O)(=O)NC1CCCCC1
InChIInChI=1S/C17H24N2O2S3/c1-11(2)14-10-22-17(18-14)15-9-16(12(3)23-15)24(20,21)19-13-7-5-4-6-8-13/h9-11,13,19H,4-8H2,1-3H3
InChIKeyNDDXUTOXQBWEDL-UHFFFAOYSA-N
MW384.59 g/mol
LogP4.91
Rot. Bonds5

About N-cyclohexyl-2-methyl-5-(4-propan-2-yl-1,3-thiazol-2-yl)thiophene-3-sulfonamide

N-cyclohexyl-2-methyl-5-(4-propan-2-yl-1,3-thiazol-2-yl)thiophene-3-sulfonamide (PubChem CID 50835214) has the molecular formula C17H24N2O2S3 and a molecular weight of 384.59 g/mol. Its IUPAC name is N-cyclohexyl-2-methyl-5-(4-propan-2-yl-1,3-thiazol-2-yl)thiophene-3-sulfonamide.

Molecular Properties

Compound NameN-cyclohexyl-2-methyl-5-(4-propan-2-yl-1,3-thiazol-2-yl)thiophene-3-sulfonamide
PubChem CID50835214
Molecular FormulaC17H24N2O2S3
Molecular Weight384.59 g/mol
Exact Mass384.10
IUPAC NameN-cyclohexyl-2-methyl-5-(4-propan-2-yl-1,3-thiazol-2-yl)thiophene-3-sulfonamide
SMILESCc1sc(-c2nc(C(C)C)cs2)cc1S(=O)(=O)NC1CCCCC1
InChIInChI=1S/C17H24N2O2S3/c1-11(2)14-10-22-17(18-14)15-9-16(12(3)23-15)24(20,21)19-13-7-5-4-6-8-13/h9-11,13,19H,4-8H2,1-3H3
InChIKeyNDDXUTOXQBWEDL-UHFFFAOYSA-N
XLogP4.91
TPSA59.06 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds5
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500384.59
LogP ≤ 54.91
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Related Compounds

N-cyclohexyl-5-(4,5-dimethyl-1,3-thiazol-2-yl)-2-methylthiophene-3-sulfonamide
CID 46392966
N-cycloheptyl-2-methyl-5-(5-methyl-1H-pyrazol-3-yl)thiophene-3-sulfonamide
CID 53138840
N-benzyl-2-methyl-5-(4-propan-2-yl-1,3-thiazol-2-yl)thiophene-3-sulfonamide
CID 50835233
N-cyclohexyl-2-methyl-5-(1,2-oxazol-5-yl)thiophene-3-sulfonamide
CID 53079450
2-[4-(4-ethylpiperazin-1-yl)sulfonyl-5-methylthiophen-2-yl]-4-propan-2-yl-1,3-thiazole
CID 50835167
2-[5-methyl-4-(4-propylpiperazin-1-yl)sulfonylthiophen-2-yl]-4-propan-2-yl-1,3-thiazole
CID 53039227
4-(cycloheptylsulfamoyl)-5-methylthiophene-2-carboxamide
CID 6502898
4-(cyclohexylsulfamoyl)-5-methylthiophene-2-carboxamide
CID 6502872
4-(cyclobutylsulfamoyl)-5-methylthiophene-2-carboxylic acid
CID 63329014
2-methyl-N-(3-methylbutyl)-5-(4-methyl-1,3-thiazol-2-yl)thiophene-3-sulfonamide
CID 46392947
N-cyclohexyl-5-(4,5-dimethyl-1,3-thiazol-2-yl)-2-methyl-N-propan-2-ylthiophene-3-sulfonamide
CID 46392984
N-cyclooctyl-4-(3-methyl-1,2-oxazol-5-yl)thiophene-2-sulfonamide
CID 46393013

Frequently Asked Questions

What is the IUPAC name of N-cyclohexyl-2-methyl-5-(4-propan-2-yl-1,3-thiazol-2-yl)thiophene-3-sulfonamide?
The IUPAC name of N-cyclohexyl-2-methyl-5-(4-propan-2-yl-1,3-thiazol-2-yl)thiophene-3-sulfonamide (CID 50835214) is N-cyclohexyl-2-methyl-5-(4-propan-2-yl-1,3-thiazol-2-yl)thiophene-3-sulfonamide.
What is the SMILES notation for N-cyclohexyl-2-methyl-5-(4-propan-2-yl-1,3-thiazol-2-yl)thiophene-3-sulfonamide?
The canonical SMILES for N-cyclohexyl-2-methyl-5-(4-propan-2-yl-1,3-thiazol-2-yl)thiophene-3-sulfonamide is Cc1sc(-c2nc(C(C)C)cs2)cc1S(=O)(=O)NC1CCCCC1.
What is the InChIKey of N-cyclohexyl-2-methyl-5-(4-propan-2-yl-1,3-thiazol-2-yl)thiophene-3-sulfonamide?
The InChIKey is NDDXUTOXQBWEDL-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H24N2O2S3/c1-11(2)14-10-22-17(18-14)15-9-16(12(3)23-15)24(20,21)19-13-7-5-4-6-8-13/h9-11,13,19H,4-8H2,1-3H3.
What are the key properties of N-cyclohexyl-2-methyl-5-(4-propan-2-yl-1,3-thiazol-2-yl)thiophene-3-sulfonamide?
N-cyclohexyl-2-methyl-5-(4-propan-2-yl-1,3-thiazol-2-yl)thiophene-3-sulfonamide has a molecular weight of 384.59 g/mol, XLogP of 4.91, 5 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N-cyclohexyl-2-methyl-5-(4-propan-2-yl-1,3-thiazol-2-yl)thiophene-3-sulfonamide is sourced from PubChem (CID 50835214), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).