2-thiophen-2-ylethylsulfamoyl carbamate

C7H10N2O4S2 — CID 87697749

IUPAC2-thiophen-2-ylethylsulfamoyl carbamate
SMILESNC(=O)OS(=O)(=O)NCCc1cccs1
InChIInChI=1S/C7H10N2O4S2/c8-7(10)13-15(11,12)9-4-3-6-2-1-5-14-6/h1-2,5,9H,3-4H2,(H2,8,10)
InChIKeyAVOGJEYRNMQVBE-UHFFFAOYSA-N
MW250.30 g/mol
LogP0.22
Rot. Bonds5

About 2-thiophen-2-ylethylsulfamoyl carbamate

2-thiophen-2-ylethylsulfamoyl carbamate (PubChem CID 87697749) has the molecular formula C7H10N2O4S2 and a molecular weight of 250.30 g/mol. Its IUPAC name is 2-thiophen-2-ylethylsulfamoyl carbamate.

Molecular Properties

Compound Name2-thiophen-2-ylethylsulfamoyl carbamate
PubChem CID87697749
Molecular FormulaC7H10N2O4S2
Molecular Weight250.30 g/mol
Exact Mass250.01
IUPAC Name2-thiophen-2-ylethylsulfamoyl carbamate
SMILESNC(=O)OS(=O)(=O)NCCc1cccs1
InChIInChI=1S/C7H10N2O4S2/c8-7(10)13-15(11,12)9-4-3-6-2-1-5-14-6/h1-2,5,9H,3-4H2,(H2,8,10)
InChIKeyAVOGJEYRNMQVBE-UHFFFAOYSA-N
XLogP0.22
TPSA98.49 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds5
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500250.30
LogP ≤ 50.22
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

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Related Compounds

N'-(2-thiophen-2-ylethyl)oxamide
CID 115192053
2-[2-(dimethylsulfamoylamino)ethyl]thiophene
CID 35309368
N-(2-thiophen-2-ylethyl)cyclopropanesulfonamide
CID 45497316
4-amino-2,6-dimethyl-N-(2-thiophen-2-ylethyl)benzenesulfonamide
CID 79588588
2-hydroxy-3-(2-thiophen-2-ylethylamino)propanamide
CID 106174788
4-(aminomethyl)-N-(2-thiophen-2-ylethyl)benzenesulfonamide
CID 18801910
4-(2-thiophen-2-ylethylsulfamoyl)thiophene-2-carboxylic acid
CID 61072796
2-amino-4-bromo-N-(2-thiophen-2-ylethyl)benzenesulfonamide
CID 43257668
N-(2-thiophen-2-ylethylsulfamoyl)cyclohexanamine
CID 110675833
2,5-difluoro-N-(2-thiophen-2-ylethyl)benzenesulfonamide
CID 40753479
2-ethylsulfonyl-N-(2-thiophen-2-ylethyl)acetamide
CID 47207166
2-[2-(methanesulfonamido)ethyl]-1-(2-thiophen-2-ylethyl)guanidine
CID 111044052

Frequently Asked Questions

What is the IUPAC name of 2-thiophen-2-ylethylsulfamoyl carbamate?
The IUPAC name of 2-thiophen-2-ylethylsulfamoyl carbamate (CID 87697749) is 2-thiophen-2-ylethylsulfamoyl carbamate.
What is the SMILES notation for 2-thiophen-2-ylethylsulfamoyl carbamate?
The canonical SMILES for 2-thiophen-2-ylethylsulfamoyl carbamate is NC(=O)OS(=O)(=O)NCCc1cccs1.
What is the InChIKey of 2-thiophen-2-ylethylsulfamoyl carbamate?
The InChIKey is AVOGJEYRNMQVBE-UHFFFAOYSA-N. The full InChI is InChI=1S/C7H10N2O4S2/c8-7(10)13-15(11,12)9-4-3-6-2-1-5-14-6/h1-2,5,9H,3-4H2,(H2,8,10).
What are the key properties of 2-thiophen-2-ylethylsulfamoyl carbamate?
2-thiophen-2-ylethylsulfamoyl carbamate has a molecular weight of 250.30 g/mol, XLogP of 0.22, 5 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 2-thiophen-2-ylethylsulfamoyl carbamate is sourced from PubChem (CID 87697749), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).