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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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).