2,2-dimethyl-N-[2-[5-[2-(methylamino)propylsulfamoyl]thiophen-2-yl]ethyl]propanamide

C15H27N3O3S2 — CID 120824426

IUPAC2,2-dimethyl-N-[2-[5-[2-(methylamino)propylsulfamoyl]thiophen-2-yl]ethyl]propanamide
SMILESCNC(C)CNS(=O)(=O)c1ccc(CCNC(=O)C(C)(C)C)s1
InChIInChI=1S/C15H27N3O3S2/c1-11(16-5)10-18-23(20,21)13-7-6-12(22-13)8-9-17-14(19)15(2,3)4/h6-7,11,16,18H,8-10H2,1-5H3,(H,17,19)
InChIKeyRUQGYWOAYSVJAO-UHFFFAOYSA-N
MW361.53 g/mol
LogP1.34
Rot. Bonds8

About 2,2-dimethyl-N-[2-[5-[2-(methylamino)propylsulfamoyl]thiophen-2-yl]ethyl]propanamide

2,2-dimethyl-N-[2-[5-[2-(methylamino)propylsulfamoyl]thiophen-2-yl]ethyl]propanamide (PubChem CID 120824426) has the molecular formula C15H27N3O3S2 and a molecular weight of 361.53 g/mol. Its IUPAC name is 2,2-dimethyl-N-[2-[5-[2-(methylamino)propylsulfamoyl]thiophen-2-yl]ethyl]propanamide.

Molecular Properties

Compound Name2,2-dimethyl-N-[2-[5-[2-(methylamino)propylsulfamoyl]thiophen-2-yl]ethyl]propanamide
PubChem CID120824426
Molecular FormulaC15H27N3O3S2
Molecular Weight361.53 g/mol
Exact Mass361.15
IUPAC Name2,2-dimethyl-N-[2-[5-[2-(methylamino)propylsulfamoyl]thiophen-2-yl]ethyl]propanamide
SMILESCNC(C)CNS(=O)(=O)c1ccc(CCNC(=O)C(C)(C)C)s1
InChIInChI=1S/C15H27N3O3S2/c1-11(16-5)10-18-23(20,21)13-7-6-12(22-13)8-9-17-14(19)15(2,3)4/h6-7,11,16,18H,8-10H2,1-5H3,(H,17,19)
InChIKeyRUQGYWOAYSVJAO-UHFFFAOYSA-N
XLogP1.34
TPSA87.30 Ų
H-Bond Donors3
H-Bond Acceptors5
Rotatable Bonds8
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500361.53
LogP ≤ 51.34
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 105

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Related Compounds

N-[2-[5-[(2-amino-2-cyclopropylethyl)sulfamoyl]thiophen-2-yl]ethyl]-2,2-dimethylpropanamide;hydrochloride
CID 120582593
N-[2-[5-(4-aminobutylsulfamoyl)thiophen-2-yl]ethyl]-2,2-dimethylpropanamide
CID 120583485
2,2-dimethyl-N-[2-[5-(1,2,3,6-tetrahydropyridin-4-ylmethylsulfamoyl)thiophen-2-yl]ethyl]propanamide;hydrochloride
CID 120721876
2,2-dimethyl-N-[2-[5-[[3-(trifluoromethyl)phenyl]sulfamoyl]thiophen-2-yl]ethyl]propanamide
CID 166195906
5-methyl-N-[2-(methylamino)propyl]thiophene-2-sulfonamide
CID 120825500
5-bromo-N-[2-(methylamino)propyl]thiophene-2-sulfonamide;hydrochloride
CID 120824454
2-[[5-(acetamidomethyl)thiophen-2-yl]sulfonylamino]-N-[2-(methylamino)propyl]acetamide;hydrochloride
CID 120831726
5-[2-(methylamino)ethyl]-N-(2-methyl-3-methylsulfanylpropyl)thiophene-2-sulfonamide
CID 106064914
N-(2-ethoxypropyl)-5-[2-(methylamino)ethyl]thiophene-2-sulfonamide
CID 106078895
5-(hydroxymethyl)-N-(2,3,3-trimethylbutyl)thiophene-2-sulfonamide
CID 83147123
2,2-dimethyl-N-[2-[5-[(3-propan-2-yl-2,3-dihydroindol-1-yl)sulfonyl]thiophen-2-yl]ethyl]propanamide
CID 139012998
2,2-dimethyl-N-[2-[5-[3-(methylamino)piperidin-1-yl]sulfonylthiophen-2-yl]ethyl]propanamide;hydrochloride
CID 120715461

Frequently Asked Questions

What is the IUPAC name of 2,2-dimethyl-N-[2-[5-[2-(methylamino)propylsulfamoyl]thiophen-2-yl]ethyl]propanamide?
The IUPAC name of 2,2-dimethyl-N-[2-[5-[2-(methylamino)propylsulfamoyl]thiophen-2-yl]ethyl]propanamide (CID 120824426) is 2,2-dimethyl-N-[2-[5-[2-(methylamino)propylsulfamoyl]thiophen-2-yl]ethyl]propanamide.
What is the SMILES notation for 2,2-dimethyl-N-[2-[5-[2-(methylamino)propylsulfamoyl]thiophen-2-yl]ethyl]propanamide?
The canonical SMILES for 2,2-dimethyl-N-[2-[5-[2-(methylamino)propylsulfamoyl]thiophen-2-yl]ethyl]propanamide is CNC(C)CNS(=O)(=O)c1ccc(CCNC(=O)C(C)(C)C)s1.
What is the InChIKey of 2,2-dimethyl-N-[2-[5-[2-(methylamino)propylsulfamoyl]thiophen-2-yl]ethyl]propanamide?
The InChIKey is RUQGYWOAYSVJAO-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H27N3O3S2/c1-11(16-5)10-18-23(20,21)13-7-6-12(22-13)8-9-17-14(19)15(2,3)4/h6-7,11,16,18H,8-10H2,1-5H3,(H,17,19).
What are the key properties of 2,2-dimethyl-N-[2-[5-[2-(methylamino)propylsulfamoyl]thiophen-2-yl]ethyl]propanamide?
2,2-dimethyl-N-[2-[5-[2-(methylamino)propylsulfamoyl]thiophen-2-yl]ethyl]propanamide has a molecular weight of 361.53 g/mol, XLogP of 1.34, 8 rotatable bonds, 3 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 2,2-dimethyl-N-[2-[5-[2-(methylamino)propylsulfamoyl]thiophen-2-yl]ethyl]propanamide is sourced from PubChem (CID 120824426), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).