N-(1-cyclopropylpropan-2-yl)-4-sulfamoyl-1H-pyrrole-2-carboxamide

C11H17N3O3S — CID 65387153

IUPACN-(1-cyclopropylpropan-2-yl)-4-sulfamoyl-1H-pyrrole-2-carboxamide
SMILESCC(CC1CC1)NC(=O)c1cc(S(N)(=O)=O)c[nH]1
InChIInChI=1S/C11H17N3O3S/c1-7(4-8-2-3-8)14-11(15)10-5-9(6-13-10)18(12,16)17/h5-8,13H,2-4H2,1H3,(H,14,15)(H2,12,16,17)
InChIKeyQOHPLVOSPBQWGS-UHFFFAOYSA-N
MW271.34 g/mol
LogP0.58
Rot. Bonds5

About N-(1-cyclopropylpropan-2-yl)-4-sulfamoyl-1H-pyrrole-2-carboxamide

N-(1-cyclopropylpropan-2-yl)-4-sulfamoyl-1H-pyrrole-2-carboxamide (PubChem CID 65387153) has the molecular formula C11H17N3O3S and a molecular weight of 271.34 g/mol. Its IUPAC name is N-(1-cyclopropylpropan-2-yl)-4-sulfamoyl-1H-pyrrole-2-carboxamide.

Molecular Properties

Compound NameN-(1-cyclopropylpropan-2-yl)-4-sulfamoyl-1H-pyrrole-2-carboxamide
PubChem CID65387153
Molecular FormulaC11H17N3O3S
Molecular Weight271.34 g/mol
Exact Mass271.10
IUPAC NameN-(1-cyclopropylpropan-2-yl)-4-sulfamoyl-1H-pyrrole-2-carboxamide
SMILESCC(CC1CC1)NC(=O)c1cc(S(N)(=O)=O)c[nH]1
InChIInChI=1S/C11H17N3O3S/c1-7(4-8-2-3-8)14-11(15)10-5-9(6-13-10)18(12,16)17/h5-8,13H,2-4H2,1H3,(H,14,15)(H2,12,16,17)
InChIKeyQOHPLVOSPBQWGS-UHFFFAOYSA-N
XLogP0.58
TPSA105.05 Ų
H-Bond Donors3
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500271.34
LogP ≤ 50.58
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 103

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Related Compounds

N-(1-cyclopropylbutan-2-yl)-4-sulfamoyl-1H-pyrrole-2-carboxamide
CID 65388887
N-(1-cyclopropylethyl)-4-sulfamoyl-1H-pyrrole-2-carboxamide
CID 65386253
N-(4-methylpentan-2-yl)-4-sulfamoyl-1H-pyrrole-2-carboxamide
CID 65388360
N-(1-methylsulfonylpropan-2-yl)-4-sulfamoyl-1H-pyrrole-2-carboxamide
CID 65380794
N-(1-cyclohexylpropyl)-4-sulfamoyl-1H-pyrrole-2-carboxamide
CID 65387692
N-(1-cyclopropylpropan-2-yl)-2-methyl-5-sulfamoylbenzamide
CID 63994388
N-(4-propylcyclohexyl)-4-sulfamoyl-1H-pyrrole-2-carboxamide
CID 65388033
N-(1-cyclopropylpropan-2-yl)-1-propan-2-yl-4-sulfamoylpyrrole-2-carboxamide
CID 114612374
N-(3-methyl-2-propan-2-ylbutyl)-4-sulfamoyl-1H-pyrrole-2-carboxamide
CID 102915536
N-(2-methylcyclopropyl)-4-sulfamoyl-1H-pyrrole-2-carboxamide
CID 65386729
4-bromo-N-(1-cyclopropylpropan-2-yl)-2-fluoro-5-sulfamoylbenzamide
CID 65388695
N-(oxan-3-ylmethyl)-4-sulfamoyl-1H-pyrrole-2-carboxamide
CID 65386323

Frequently Asked Questions

What is the IUPAC name of N-(1-cyclopropylpropan-2-yl)-4-sulfamoyl-1H-pyrrole-2-carboxamide?
The IUPAC name of N-(1-cyclopropylpropan-2-yl)-4-sulfamoyl-1H-pyrrole-2-carboxamide (CID 65387153) is N-(1-cyclopropylpropan-2-yl)-4-sulfamoyl-1H-pyrrole-2-carboxamide.
What is the SMILES notation for N-(1-cyclopropylpropan-2-yl)-4-sulfamoyl-1H-pyrrole-2-carboxamide?
The canonical SMILES for N-(1-cyclopropylpropan-2-yl)-4-sulfamoyl-1H-pyrrole-2-carboxamide is CC(CC1CC1)NC(=O)c1cc(S(N)(=O)=O)c[nH]1.
What is the InChIKey of N-(1-cyclopropylpropan-2-yl)-4-sulfamoyl-1H-pyrrole-2-carboxamide?
The InChIKey is QOHPLVOSPBQWGS-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H17N3O3S/c1-7(4-8-2-3-8)14-11(15)10-5-9(6-13-10)18(12,16)17/h5-8,13H,2-4H2,1H3,(H,14,15)(H2,12,16,17).
What are the key properties of N-(1-cyclopropylpropan-2-yl)-4-sulfamoyl-1H-pyrrole-2-carboxamide?
N-(1-cyclopropylpropan-2-yl)-4-sulfamoyl-1H-pyrrole-2-carboxamide has a molecular weight of 271.34 g/mol, XLogP of 0.58, 5 rotatable bonds, 3 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-(1-cyclopropylpropan-2-yl)-4-sulfamoyl-1H-pyrrole-2-carboxamide is sourced from PubChem (CID 65387153), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).