2-[(diethylsulfamoylamino)methyl]-3-methylthiophene

C10H18N2O2S2 — CID 35610330

IUPAC2-[(diethylsulfamoylamino)methyl]-3-methylthiophene
SMILESCCN(CC)S(=O)(=O)NCc1sccc1C
InChIInChI=1S/C10H18N2O2S2/c1-4-12(5-2)16(13,14)11-8-10-9(3)6-7-15-10/h6-7,11H,4-5,8H2,1-3H3
InChIKeyZPICJFXCYGECKJ-UHFFFAOYSA-N
MW262.40 g/mol
LogP1.73
Rot. Bonds6

About 2-[(diethylsulfamoylamino)methyl]-3-methylthiophene

2-[(diethylsulfamoylamino)methyl]-3-methylthiophene (PubChem CID 35610330) has the molecular formula C10H18N2O2S2 and a molecular weight of 262.40 g/mol. Its IUPAC name is 2-[(diethylsulfamoylamino)methyl]-3-methylthiophene.

Molecular Properties

Compound Name2-[(diethylsulfamoylamino)methyl]-3-methylthiophene
PubChem CID35610330
Molecular FormulaC10H18N2O2S2
Molecular Weight262.40 g/mol
Exact Mass262.08
IUPAC Name2-[(diethylsulfamoylamino)methyl]-3-methylthiophene
SMILESCCN(CC)S(=O)(=O)NCc1sccc1C
InChIInChI=1S/C10H18N2O2S2/c1-4-12(5-2)16(13,14)11-8-10-9(3)6-7-15-10/h6-7,11H,4-5,8H2,1-3H3
InChIKeyZPICJFXCYGECKJ-UHFFFAOYSA-N
XLogP1.73
TPSA49.41 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds6
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500262.40
LogP ≤ 51.73
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

N-[(3-methylthiophen-2-yl)methyl]benzenesulfonamide
CID 2811533
1-[[4-(diethylsulfamoyl)phenyl]methyl]-3-[(3-methylthiophen-2-yl)methyl]urea
CID 33421340
1,1-dimethyl-2-[(3-methylthiophen-2-yl)methyl]hydrazine
CID 83003822
N-[(3-methylthiophen-2-yl)methyl]-2-propylsulfonylethanamine
CID 106513305
1-(aminomethyl)-4-[(diethylsulfamoylamino)methyl]benzene
CID 54936307
5-bromo-2-methoxy-N-[(3-methylthiophen-2-yl)methyl]benzenesulfonamide
CID 35609931
3-bromo-5-(hydroxymethyl)-2-methyl-N-[(3-methylthiophen-2-yl)methyl]benzenesulfonamide
CID 81480783
3-methyl-2-(methylsulfonylmethyl)thiophene
CID 86036540
2-butylsulfonyl-N-[(3-methylthiophen-2-yl)methyl]ethanamine
CID 106512473
2-[(3-methylthiophen-2-yl)methylamino]acetaldehyde
CID 115223017
1,1-dimethyl-3-[(3-methylthiophen-2-yl)methyl]urea
CID 115579180
4-methyl-3-[(3-methylthiophen-2-yl)methylsulfamoyl]benzoic acid
CID 112726216

Frequently Asked Questions

What is the IUPAC name of 2-[(diethylsulfamoylamino)methyl]-3-methylthiophene?
The IUPAC name of 2-[(diethylsulfamoylamino)methyl]-3-methylthiophene (CID 35610330) is 2-[(diethylsulfamoylamino)methyl]-3-methylthiophene.
What is the SMILES notation for 2-[(diethylsulfamoylamino)methyl]-3-methylthiophene?
The canonical SMILES for 2-[(diethylsulfamoylamino)methyl]-3-methylthiophene is CCN(CC)S(=O)(=O)NCc1sccc1C.
What is the InChIKey of 2-[(diethylsulfamoylamino)methyl]-3-methylthiophene?
The InChIKey is ZPICJFXCYGECKJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H18N2O2S2/c1-4-12(5-2)16(13,14)11-8-10-9(3)6-7-15-10/h6-7,11H,4-5,8H2,1-3H3.
What are the key properties of 2-[(diethylsulfamoylamino)methyl]-3-methylthiophene?
2-[(diethylsulfamoylamino)methyl]-3-methylthiophene has a molecular weight of 262.40 g/mol, XLogP of 1.73, 6 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[(diethylsulfamoylamino)methyl]-3-methylthiophene is sourced from PubChem (CID 35610330), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).