4-[cyclohexyl(methyl)sulfamoyl]-N-(1-thiophen-2-ylpropyl)benzamide

C21H28N2O3S2 — CID 55908392

IUPAC4-[cyclohexyl(methyl)sulfamoyl]-N-(1-thiophen-2-ylpropyl)benzamide
SMILESCCC(NC(=O)c1ccc(S(=O)(=O)N(C)C2CCCCC2)cc1)c1cccs1
InChIInChI=1S/C21H28N2O3S2/c1-3-19(20-10-7-15-27-20)22-21(24)16-11-13-18(14-12-16)28(25,26)23(2)17-8-5-4-6-9-17/h7,10-15,17,19H,3-6,8-9H2,1-2H3,(H,22,24)
InChIKeyLUIUGFCHGMPBES-UHFFFAOYSA-N
MW420.60 g/mol
LogP4.58
Rot. Bonds7

About 4-[cyclohexyl(methyl)sulfamoyl]-N-(1-thiophen-2-ylpropyl)benzamide

4-[cyclohexyl(methyl)sulfamoyl]-N-(1-thiophen-2-ylpropyl)benzamide (PubChem CID 55908392) has the molecular formula C21H28N2O3S2 and a molecular weight of 420.60 g/mol. Its IUPAC name is 4-[cyclohexyl(methyl)sulfamoyl]-N-(1-thiophen-2-ylpropyl)benzamide.

Molecular Properties

Compound Name4-[cyclohexyl(methyl)sulfamoyl]-N-(1-thiophen-2-ylpropyl)benzamide
PubChem CID55908392
Molecular FormulaC21H28N2O3S2
Molecular Weight420.60 g/mol
Exact Mass420.15
IUPAC Name4-[cyclohexyl(methyl)sulfamoyl]-N-(1-thiophen-2-ylpropyl)benzamide
SMILESCCC(NC(=O)c1ccc(S(=O)(=O)N(C)C2CCCCC2)cc1)c1cccs1
InChIInChI=1S/C21H28N2O3S2/c1-3-19(20-10-7-15-27-20)22-21(24)16-11-13-18(14-12-16)28(25,26)23(2)17-8-5-4-6-9-17/h7,10-15,17,19H,3-6,8-9H2,1-2H3,(H,22,24)
InChIKeyLUIUGFCHGMPBES-UHFFFAOYSA-N
XLogP4.58
TPSA66.48 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds7
Heavy Atoms28
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500420.60
LogP ≤ 54.58
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

4-(ethylsulfamoyl)-N-(1-thiophen-2-ylpropyl)benzamide
CID 55954354
4-[cyclohexyl(methyl)sulfamoyl]-N-(3-methylbutan-2-yl)benzamide
CID 55450487
4-[cyclohexyl(methyl)sulfamoyl]-N-(2-thiophen-2-ylphenyl)benzamide
CID 55469203
N-(1-aminohexan-2-yl)-4-[cyclohexyl(methyl)sulfamoyl]benzamide;hydrochloride
CID 119667060
4-[cyclohexyl(methyl)sulfamoyl]-N-(5-thiophen-2-yl-1H-pyrazol-3-yl)benzamide
CID 60551556
N-(3-cyanothiophen-2-yl)-4-[cyclopentyl(methyl)sulfamoyl]benzamide
CID 7656091
methyl N-[2-[[4-[cyclopentyl(methyl)sulfamoyl]benzoyl]amino]thiophene-3-carbonyl]carbamate
CID 43947365
4-[cyclopentyl(methyl)sulfamoyl]-N-(1,3-thiazol-2-yl)benzamide
CID 7656045
4-[cyclopentyl(methyl)sulfamoyl]-N-phenylbenzamide
CID 7656046
4-(dimethylsulfamoyl)-N-[(1R)-1-thiophen-2-ylethyl]benzamide
CID 7918075
N-(2-aminoethyl)-4-[cyclohexyl(methyl)sulfamoyl]benzamide;hydrochloride
CID 119384031
4-[cyclohexyl(methyl)sulfamoyl]-N-cyclopentyl-N-ethylbenzamide
CID 134060936

Frequently Asked Questions

What is the IUPAC name of 4-[cyclohexyl(methyl)sulfamoyl]-N-(1-thiophen-2-ylpropyl)benzamide?
The IUPAC name of 4-[cyclohexyl(methyl)sulfamoyl]-N-(1-thiophen-2-ylpropyl)benzamide (CID 55908392) is 4-[cyclohexyl(methyl)sulfamoyl]-N-(1-thiophen-2-ylpropyl)benzamide.
What is the SMILES notation for 4-[cyclohexyl(methyl)sulfamoyl]-N-(1-thiophen-2-ylpropyl)benzamide?
The canonical SMILES for 4-[cyclohexyl(methyl)sulfamoyl]-N-(1-thiophen-2-ylpropyl)benzamide is CCC(NC(=O)c1ccc(S(=O)(=O)N(C)C2CCCCC2)cc1)c1cccs1.
What is the InChIKey of 4-[cyclohexyl(methyl)sulfamoyl]-N-(1-thiophen-2-ylpropyl)benzamide?
The InChIKey is LUIUGFCHGMPBES-UHFFFAOYSA-N. The full InChI is InChI=1S/C21H28N2O3S2/c1-3-19(20-10-7-15-27-20)22-21(24)16-11-13-18(14-12-16)28(25,26)23(2)17-8-5-4-6-9-17/h7,10-15,17,19H,3-6,8-9H2,1-2H3,(H,22,24).
What are the key properties of 4-[cyclohexyl(methyl)sulfamoyl]-N-(1-thiophen-2-ylpropyl)benzamide?
4-[cyclohexyl(methyl)sulfamoyl]-N-(1-thiophen-2-ylpropyl)benzamide has a molecular weight of 420.60 g/mol, XLogP of 4.58, 7 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 4-[cyclohexyl(methyl)sulfamoyl]-N-(1-thiophen-2-ylpropyl)benzamide is sourced from PubChem (CID 55908392), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).