N-[(1R)-1-[4-(diethylsulfamoyl)phenyl]ethyl]-5-methylthiophene-2-carboxamide

C18H24N2O3S2 — CID 31526246

IUPACN-[(1R)-1-[4-(diethylsulfamoyl)phenyl]ethyl]-5-methylthiophene-2-carboxamide
SMILESCCN(CC)S(=O)(=O)c1ccc([C@@H](C)NC(=O)c2ccc(C)s2)cc1
InChIInChI=1S/C18H24N2O3S2/c1-5-20(6-2)25(22,23)16-10-8-15(9-11-16)14(4)19-18(21)17-12-7-13(3)24-17/h7-12,14H,5-6H2,1-4H3,(H,19,21)/t14-/m1/s1
InChIKeyIGWBGOXMZBVLLJ-CQSZACIVSA-N
MW380.54 g/mol
LogP3.58
Rot. Bonds7

About N-[(1R)-1-[4-(diethylsulfamoyl)phenyl]ethyl]-5-methylthiophene-2-carboxamide

N-[(1R)-1-[4-(diethylsulfamoyl)phenyl]ethyl]-5-methylthiophene-2-carboxamide (PubChem CID 31526246) has the molecular formula C18H24N2O3S2 and a molecular weight of 380.54 g/mol. Its IUPAC name is N-[(1R)-1-[4-(diethylsulfamoyl)phenyl]ethyl]-5-methylthiophene-2-carboxamide.

Molecular Properties

Compound NameN-[(1R)-1-[4-(diethylsulfamoyl)phenyl]ethyl]-5-methylthiophene-2-carboxamide
PubChem CID31526246
Molecular FormulaC18H24N2O3S2
Molecular Weight380.54 g/mol
Exact Mass380.12
IUPAC NameN-[(1R)-1-[4-(diethylsulfamoyl)phenyl]ethyl]-5-methylthiophene-2-carboxamide
SMILESCCN(CC)S(=O)(=O)c1ccc([C@@H](C)NC(=O)c2ccc(C)s2)cc1
InChIInChI=1S/C18H24N2O3S2/c1-5-20(6-2)25(22,23)16-10-8-15(9-11-16)14(4)19-18(21)17-12-7-13(3)24-17/h7-12,14H,5-6H2,1-4H3,(H,19,21)/t14-/m1/s1
InChIKeyIGWBGOXMZBVLLJ-CQSZACIVSA-N
XLogP3.58
TPSA66.48 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds7
Heavy Atoms25
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500380.54
LogP ≤ 53.58
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

5-methyl-N-[(1S)-1-(4-sulfamoylphenyl)ethyl]thiophene-2-carboxamide
CID 2594407
N-[1-[4-(diethylsulfamoyl)phenyl]ethyl]-2-(5-methylthiophen-2-yl)acetamide
CID 60580112
N-[1-(4-ethylphenyl)ethyl]-5-methylthiophene-2-carboxamide
CID 17326902
(2R)-2-amino-N-[1-[4-(diethylsulfamoyl)phenyl]ethyl]propanamide
CID 119269826
(2R)-2-amino-N-[1-[4-(diethylsulfamoyl)phenyl]ethyl]propanamide;hydrochloride
CID 119269825
N-[1-[4-(diethylsulfamoyl)phenyl]ethyl]-4-iodobenzamide
CID 55339070
N-[1-[4-(diethylsulfamoyl)phenyl]ethyl]-2,6-difluorobenzamide
CID 51151532
2,3-dichloro-N-[1-[4-(diethylsulfamoyl)phenyl]ethyl]benzamide
CID 112765419
N-[(1S)-1-[4-(diethylsulfamoyl)phenyl]ethyl]-2-(trifluoromethyl)benzamide
CID 32752664
3-amino-N-[1-[4-(diethylsulfamoyl)phenyl]ethyl]butanamide;hydrochloride
CID 119686834
N-[1-[4-(diethylsulfamoyl)phenyl]ethyl]-4-methoxybenzamide
CID 51151516
N-[(1S)-1-[4-(diethylsulfamoyl)phenyl]ethyl]-3-methylbut-2-enamide
CID 31540675

Frequently Asked Questions

What is the IUPAC name of N-[(1R)-1-[4-(diethylsulfamoyl)phenyl]ethyl]-5-methylthiophene-2-carboxamide?
The IUPAC name of N-[(1R)-1-[4-(diethylsulfamoyl)phenyl]ethyl]-5-methylthiophene-2-carboxamide (CID 31526246) is N-[(1R)-1-[4-(diethylsulfamoyl)phenyl]ethyl]-5-methylthiophene-2-carboxamide.
What is the SMILES notation for N-[(1R)-1-[4-(diethylsulfamoyl)phenyl]ethyl]-5-methylthiophene-2-carboxamide?
The canonical SMILES for N-[(1R)-1-[4-(diethylsulfamoyl)phenyl]ethyl]-5-methylthiophene-2-carboxamide is CCN(CC)S(=O)(=O)c1ccc([C@@H](C)NC(=O)c2ccc(C)s2)cc1.
What is the InChIKey of N-[(1R)-1-[4-(diethylsulfamoyl)phenyl]ethyl]-5-methylthiophene-2-carboxamide?
The InChIKey is IGWBGOXMZBVLLJ-CQSZACIVSA-N. The full InChI is InChI=1S/C18H24N2O3S2/c1-5-20(6-2)25(22,23)16-10-8-15(9-11-16)14(4)19-18(21)17-12-7-13(3)24-17/h7-12,14H,5-6H2,1-4H3,(H,19,21)/t14-/m1/s1.
What are the key properties of N-[(1R)-1-[4-(diethylsulfamoyl)phenyl]ethyl]-5-methylthiophene-2-carboxamide?
N-[(1R)-1-[4-(diethylsulfamoyl)phenyl]ethyl]-5-methylthiophene-2-carboxamide has a molecular weight of 380.54 g/mol, XLogP of 3.58, 7 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-[(1R)-1-[4-(diethylsulfamoyl)phenyl]ethyl]-5-methylthiophene-2-carboxamide is sourced from PubChem (CID 31526246), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).