N-(cyclopropylmethyl)-5-methyl-N-propyl-4-sulfamoylthiophene-2-carboxamide

C13H20N2O3S2 — CID 115612410

IUPACN-(cyclopropylmethyl)-5-methyl-N-propyl-4-sulfamoylthiophene-2-carboxamide
SMILESCCCN(CC1CC1)C(=O)c1cc(S(N)(=O)=O)c(C)s1
InChIInChI=1S/C13H20N2O3S2/c1-3-6-15(8-10-4-5-10)13(16)11-7-12(9(2)19-11)20(14,17)18/h7,10H,3-6,8H2,1-2H3,(H2,14,17,18)
InChIKeyMJHWJHJUVXBHAG-UHFFFAOYSA-N
MW316.45 g/mol
LogP1.97
Rot. Bonds6

About N-(cyclopropylmethyl)-5-methyl-N-propyl-4-sulfamoylthiophene-2-carboxamide

N-(cyclopropylmethyl)-5-methyl-N-propyl-4-sulfamoylthiophene-2-carboxamide (PubChem CID 115612410) has the molecular formula C13H20N2O3S2 and a molecular weight of 316.45 g/mol. Its IUPAC name is N-(cyclopropylmethyl)-5-methyl-N-propyl-4-sulfamoylthiophene-2-carboxamide.

Molecular Properties

Compound NameN-(cyclopropylmethyl)-5-methyl-N-propyl-4-sulfamoylthiophene-2-carboxamide
PubChem CID115612410
Molecular FormulaC13H20N2O3S2
Molecular Weight316.45 g/mol
Exact Mass316.09
IUPAC NameN-(cyclopropylmethyl)-5-methyl-N-propyl-4-sulfamoylthiophene-2-carboxamide
SMILESCCCN(CC1CC1)C(=O)c1cc(S(N)(=O)=O)c(C)s1
InChIInChI=1S/C13H20N2O3S2/c1-3-6-15(8-10-4-5-10)13(16)11-7-12(9(2)19-11)20(14,17)18/h7,10H,3-6,8H2,1-2H3,(H2,14,17,18)
InChIKeyMJHWJHJUVXBHAG-UHFFFAOYSA-N
XLogP1.97
TPSA80.47 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds6
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500316.45
LogP ≤ 51.97
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

N,N-bis(cyclopropylmethyl)-5-methyl-4-sulfamoylthiophene-2-carboxamide
CID 115629451
5-[cyclopropylmethyl(propyl)carbamoyl]-2-methylthiophene-3-sulfonyl chloride
CID 115994032
N-butyl-N-cyclopropyl-5-methyl-4-sulfamoylthiophene-2-carboxamide
CID 115612426
N-(cyclopropylmethyl)-2-methyl-N-propyl-5-sulfamoylbenzamide
CID 60637766
N-butyl-N,5-dimethyl-4-sulfamoylthiophene-2-carboxamide
CID 112689667
N,5-dimethyl-N-pentyl-4-sulfamoylthiophene-2-carboxamide
CID 112676812
N-cyclopropyl-N,5-dimethyl-4-sulfamoylthiophene-2-carboxamide
CID 112689679
N-(cyclopropylmethyl)-N-propyl-1-benzothiophene-2-carboxamide
CID 134029193
5-[cyclopropylmethyl(propyl)carbamoyl]thiophene-2-carboxylic acid
CID 60722178
N,5-dimethyl-N-(2-methylpropyl)-4-sulfamoylthiophene-2-carboxamide
CID 112689674
4-[cyclopropylmethyl(methyl)sulfamoyl]-5-methylthiophene-2-carboxylic acid
CID 55200554
N-(2,2-difluoroethyl)-N,5-dimethyl-4-sulfamoylthiophene-2-carboxamide
CID 115612484

Frequently Asked Questions

What is the IUPAC name of N-(cyclopropylmethyl)-5-methyl-N-propyl-4-sulfamoylthiophene-2-carboxamide?
The IUPAC name of N-(cyclopropylmethyl)-5-methyl-N-propyl-4-sulfamoylthiophene-2-carboxamide (CID 115612410) is N-(cyclopropylmethyl)-5-methyl-N-propyl-4-sulfamoylthiophene-2-carboxamide.
What is the SMILES notation for N-(cyclopropylmethyl)-5-methyl-N-propyl-4-sulfamoylthiophene-2-carboxamide?
The canonical SMILES for N-(cyclopropylmethyl)-5-methyl-N-propyl-4-sulfamoylthiophene-2-carboxamide is CCCN(CC1CC1)C(=O)c1cc(S(N)(=O)=O)c(C)s1.
What is the InChIKey of N-(cyclopropylmethyl)-5-methyl-N-propyl-4-sulfamoylthiophene-2-carboxamide?
The InChIKey is MJHWJHJUVXBHAG-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H20N2O3S2/c1-3-6-15(8-10-4-5-10)13(16)11-7-12(9(2)19-11)20(14,17)18/h7,10H,3-6,8H2,1-2H3,(H2,14,17,18).
What are the key properties of N-(cyclopropylmethyl)-5-methyl-N-propyl-4-sulfamoylthiophene-2-carboxamide?
N-(cyclopropylmethyl)-5-methyl-N-propyl-4-sulfamoylthiophene-2-carboxamide has a molecular weight of 316.45 g/mol, XLogP of 1.97, 6 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-(cyclopropylmethyl)-5-methyl-N-propyl-4-sulfamoylthiophene-2-carboxamide is sourced from PubChem (CID 115612410), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).