N-(1-amino-2-cyclopropylpropan-2-yl)-2-methyl-5-(methylsulfamoyl)furan-3-carboxamide

C13H21N3O4S — CID 119574590

IUPACN-(1-amino-2-cyclopropylpropan-2-yl)-2-methyl-5-(methylsulfamoyl)furan-3-carboxamide
SMILESCNS(=O)(=O)c1cc(C(=O)NC(C)(CN)C2CC2)c(C)o1
InChIInChI=1S/C13H21N3O4S/c1-8-10(6-11(20-8)21(18,19)15-3)12(17)16-13(2,7-14)9-4-5-9/h6,9,15H,4-5,7,14H2,1-3H3,(H,16,17)
InChIKeyNARMIHOLNWRIJI-UHFFFAOYSA-N
MW315.40 g/mol
LogP0.35
Rot. Bonds6

About N-(1-amino-2-cyclopropylpropan-2-yl)-2-methyl-5-(methylsulfamoyl)furan-3-carboxamide

N-(1-amino-2-cyclopropylpropan-2-yl)-2-methyl-5-(methylsulfamoyl)furan-3-carboxamide (PubChem CID 119574590) has the molecular formula C13H21N3O4S and a molecular weight of 315.40 g/mol. Its IUPAC name is N-(1-amino-2-cyclopropylpropan-2-yl)-2-methyl-5-(methylsulfamoyl)furan-3-carboxamide.

Molecular Properties

Compound NameN-(1-amino-2-cyclopropylpropan-2-yl)-2-methyl-5-(methylsulfamoyl)furan-3-carboxamide
PubChem CID119574590
Molecular FormulaC13H21N3O4S
Molecular Weight315.40 g/mol
Exact Mass315.13
IUPAC NameN-(1-amino-2-cyclopropylpropan-2-yl)-2-methyl-5-(methylsulfamoyl)furan-3-carboxamide
SMILESCNS(=O)(=O)c1cc(C(=O)NC(C)(CN)C2CC2)c(C)o1
InChIInChI=1S/C13H21N3O4S/c1-8-10(6-11(20-8)21(18,19)15-3)12(17)16-13(2,7-14)9-4-5-9/h6,9,15H,4-5,7,14H2,1-3H3,(H,16,17)
InChIKeyNARMIHOLNWRIJI-UHFFFAOYSA-N
XLogP0.35
TPSA114.43 Ų
H-Bond Donors3
H-Bond Acceptors5
Rotatable Bonds6
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500315.40
LogP ≤ 50.35
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 105

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Related Compounds

N-butyl-2-methyl-5-(piperidinosulfonyl)-3-furamide
CID 2809633
2,5-dimethyl-N-[2-(4-sulfamoylphenyl)ethyl]furan-3-carboxamide
CID 2443198
N-[4-(aminosulfonyl)benzyl]-2,5-dimethyl-3-furamide
CID 1245537
N-[[2-(dimethylsulfamoyl)phenyl]methyl]-2,4,5-trimethylfuran-3-carboxamide
CID 30459449
2,4,5-trimethyl-N-[[4-(methylsulfamoyl)phenyl]methyl]furan-3-carboxamide
CID 45810418
2,4,5-trimethyl-N-[[3-(methylsulfamoyl)phenyl]methyl]furan-3-carboxamide
CID 45816489
N-butyl-5-(dimethylsulfamoyl)-2-methylfuran-3-carboxamide
CID 2809674
2-methyl-N-[2-(2-oxoimidazolidin-1-yl)ethyl]-5-pyrrolidin-1-ylsulfonylfuran-3-carboxamide
CID 2810879
N-[(1-methanesulfonylpiperidin-4-yl)methyl]-2,5-dimethylfuran-3-carboxamide
CID 49688200
N-((1-(cyclopropylsulfonyl)piperidin-4-yl)methyl)-2,5-dimethylfuran-3-carboxamide
CID 49692182
N-(3-methoxypropyl)-2,5-dimethyl-4-sulfamoylfuran-3-carboxamide
CID 45830571
N-[2-(methanesulfonamido)ethyl]-N,2,5-trimethylfuran-3-carboxamide
CID 60307284

Frequently Asked Questions

What is the IUPAC name of N-(1-amino-2-cyclopropylpropan-2-yl)-2-methyl-5-(methylsulfamoyl)furan-3-carboxamide?
The IUPAC name of N-(1-amino-2-cyclopropylpropan-2-yl)-2-methyl-5-(methylsulfamoyl)furan-3-carboxamide (CID 119574590) is N-(1-amino-2-cyclopropylpropan-2-yl)-2-methyl-5-(methylsulfamoyl)furan-3-carboxamide.
What is the SMILES notation for N-(1-amino-2-cyclopropylpropan-2-yl)-2-methyl-5-(methylsulfamoyl)furan-3-carboxamide?
The canonical SMILES for N-(1-amino-2-cyclopropylpropan-2-yl)-2-methyl-5-(methylsulfamoyl)furan-3-carboxamide is CNS(=O)(=O)c1cc(C(=O)NC(C)(CN)C2CC2)c(C)o1.
What is the InChIKey of N-(1-amino-2-cyclopropylpropan-2-yl)-2-methyl-5-(methylsulfamoyl)furan-3-carboxamide?
The InChIKey is NARMIHOLNWRIJI-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H21N3O4S/c1-8-10(6-11(20-8)21(18,19)15-3)12(17)16-13(2,7-14)9-4-5-9/h6,9,15H,4-5,7,14H2,1-3H3,(H,16,17).
What are the key properties of N-(1-amino-2-cyclopropylpropan-2-yl)-2-methyl-5-(methylsulfamoyl)furan-3-carboxamide?
N-(1-amino-2-cyclopropylpropan-2-yl)-2-methyl-5-(methylsulfamoyl)furan-3-carboxamide has a molecular weight of 315.40 g/mol, XLogP of 0.35, 6 rotatable bonds, 3 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N-(1-amino-2-cyclopropylpropan-2-yl)-2-methyl-5-(methylsulfamoyl)furan-3-carboxamide is sourced from PubChem (CID 119574590), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).