3-[cyclohexyl(methyl)sulfamoyl]-N-methyl-N-(thiophen-3-ylmethyl)benzamide

C20H26N2O3S2 — CID 43017747

IUPAC3-[cyclohexyl(methyl)sulfamoyl]-N-methyl-N-(thiophen-3-ylmethyl)benzamide
SMILESCN(Cc1ccsc1)C(=O)c1cccc(S(=O)(=O)N(C)C2CCCCC2)c1
InChIInChI=1S/C20H26N2O3S2/c1-21(14-16-11-12-26-15-16)20(23)17-7-6-10-19(13-17)27(24,25)22(2)18-8-4-3-5-9-18/h6-7,10-13,15,18H,3-5,8-9,14H2,1-2H3
InChIKeyJACUAXZFIFJBFT-UHFFFAOYSA-N
MW406.57 g/mol
LogP3.97
Rot. Bonds6

About 3-[cyclohexyl(methyl)sulfamoyl]-N-methyl-N-(thiophen-3-ylmethyl)benzamide

3-[cyclohexyl(methyl)sulfamoyl]-N-methyl-N-(thiophen-3-ylmethyl)benzamide (PubChem CID 43017747) has the molecular formula C20H26N2O3S2 and a molecular weight of 406.57 g/mol. Its IUPAC name is 3-[cyclohexyl(methyl)sulfamoyl]-N-methyl-N-(thiophen-3-ylmethyl)benzamide.

Molecular Properties

Compound Name3-[cyclohexyl(methyl)sulfamoyl]-N-methyl-N-(thiophen-3-ylmethyl)benzamide
PubChem CID43017747
Molecular FormulaC20H26N2O3S2
Molecular Weight406.57 g/mol
Exact Mass406.14
IUPAC Name3-[cyclohexyl(methyl)sulfamoyl]-N-methyl-N-(thiophen-3-ylmethyl)benzamide
SMILESCN(Cc1ccsc1)C(=O)c1cccc(S(=O)(=O)N(C)C2CCCCC2)c1
InChIInChI=1S/C20H26N2O3S2/c1-21(14-16-11-12-26-15-16)20(23)17-7-6-10-19(13-17)27(24,25)22(2)18-8-4-3-5-9-18/h6-7,10-13,15,18H,3-5,8-9,14H2,1-2H3
InChIKeyJACUAXZFIFJBFT-UHFFFAOYSA-N
XLogP3.97
TPSA57.69 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds6
Heavy Atoms27
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500406.57
LogP ≤ 53.97
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

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Related Compounds

N-methyl-3-methylsulfonyl-N-(thiophen-3-ylmethyl)benzamide
CID 18117252
3-[cyclohexyl(methyl)sulfamoyl]-N-methyl-N-[(5-methylfuran-2-yl)methyl]benzamide
CID 31150760
N-(1,3-benzothiazol-2-ylmethyl)-3-[cyclohexyl(methyl)sulfamoyl]-N-methylbenzamide
CID 17411471
3-[cyclopentyl(methyl)sulfamoyl]benzoic acid
CID 43213252
3-[cyclohexyl(methyl)sulfamoyl]-N-methyl-N-[2-(2-methylphenoxy)ethyl]benzamide
CID 46508301
3-[cyclohexyl(methyl)sulfamoyl]-N-(2-thiophen-2-ylethyl)benzamide
CID 43008206
4-[cyclohexyl(methyl)sulfamoyl]-N-[[4-(dimethylamino)phenyl]methyl]-N-methylbenzamide
CID 27861404
3-[cyclohexyl(methyl)sulfamoyl]-N-methyl-N-piperidin-4-ylbenzamide;hydrochloride
CID 119442993
3-[[3-[cyclohexyl(methyl)sulfamoyl]benzoyl]-ethylamino]propanoic acid
CID 120685984
3-[[3-[cyclohexyl(methyl)sulfamoyl]benzoyl]amino]-2-methylpropanoic acid
CID 120687513
3-[cyclohexyl(methyl)sulfamoyl]-N-ethoxybenzamide
CID 43048017
N-methyl-N-(thiophen-3-ylmethyl)cyclohexanecarboxamide
CID 39966819

Frequently Asked Questions

What is the IUPAC name of 3-[cyclohexyl(methyl)sulfamoyl]-N-methyl-N-(thiophen-3-ylmethyl)benzamide?
The IUPAC name of 3-[cyclohexyl(methyl)sulfamoyl]-N-methyl-N-(thiophen-3-ylmethyl)benzamide (CID 43017747) is 3-[cyclohexyl(methyl)sulfamoyl]-N-methyl-N-(thiophen-3-ylmethyl)benzamide.
What is the SMILES notation for 3-[cyclohexyl(methyl)sulfamoyl]-N-methyl-N-(thiophen-3-ylmethyl)benzamide?
The canonical SMILES for 3-[cyclohexyl(methyl)sulfamoyl]-N-methyl-N-(thiophen-3-ylmethyl)benzamide is CN(Cc1ccsc1)C(=O)c1cccc(S(=O)(=O)N(C)C2CCCCC2)c1.
What is the InChIKey of 3-[cyclohexyl(methyl)sulfamoyl]-N-methyl-N-(thiophen-3-ylmethyl)benzamide?
The InChIKey is JACUAXZFIFJBFT-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H26N2O3S2/c1-21(14-16-11-12-26-15-16)20(23)17-7-6-10-19(13-17)27(24,25)22(2)18-8-4-3-5-9-18/h6-7,10-13,15,18H,3-5,8-9,14H2,1-2H3.
What are the key properties of 3-[cyclohexyl(methyl)sulfamoyl]-N-methyl-N-(thiophen-3-ylmethyl)benzamide?
3-[cyclohexyl(methyl)sulfamoyl]-N-methyl-N-(thiophen-3-ylmethyl)benzamide has a molecular weight of 406.57 g/mol, XLogP of 3.97, 6 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 3-[cyclohexyl(methyl)sulfamoyl]-N-methyl-N-(thiophen-3-ylmethyl)benzamide is sourced from PubChem (CID 43017747), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).