4-(2-hydroxypropylsulfamoyl)-1-methylpyrrole-2-carboxamide

C9H15N3O4S — CID 43502336

IUPAC4-(2-hydroxypropylsulfamoyl)-1-methylpyrrole-2-carboxamide
SMILESCC(O)CNS(=O)(=O)c1cc(C(N)=O)n(C)c1
InChIInChI=1S/C9H15N3O4S/c1-6(13)4-11-17(15,16)7-3-8(9(10)14)12(2)5-7/h3,5-6,11,13H,4H2,1-2H3,(H2,10,14)
InChIKeyGPFPPRDQIVITQD-UHFFFAOYSA-N
MW261.30 g/mol
LogP-1.22
Rot. Bonds5

About 4-(2-hydroxypropylsulfamoyl)-1-methylpyrrole-2-carboxamide

4-(2-hydroxypropylsulfamoyl)-1-methylpyrrole-2-carboxamide (PubChem CID 43502336) has the molecular formula C9H15N3O4S and a molecular weight of 261.30 g/mol. Its IUPAC name is 4-(2-hydroxypropylsulfamoyl)-1-methylpyrrole-2-carboxamide.

Molecular Properties

Compound Name4-(2-hydroxypropylsulfamoyl)-1-methylpyrrole-2-carboxamide
PubChem CID43502336
Molecular FormulaC9H15N3O4S
Molecular Weight261.30 g/mol
Exact Mass261.08
IUPAC Name4-(2-hydroxypropylsulfamoyl)-1-methylpyrrole-2-carboxamide
SMILESCC(O)CNS(=O)(=O)c1cc(C(N)=O)n(C)c1
InChIInChI=1S/C9H15N3O4S/c1-6(13)4-11-17(15,16)7-3-8(9(10)14)12(2)5-7/h3,5-6,11,13H,4H2,1-2H3,(H2,10,14)
InChIKeyGPFPPRDQIVITQD-UHFFFAOYSA-N
XLogP-1.22
TPSA114.42 Ų
H-Bond Donors3
H-Bond Acceptors5
Rotatable Bonds5
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500261.30
LogP ≤ 5-1.22
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 105

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Related Compounds

4-[[(2R)-2-hydroxypropyl]sulfamoyl]-1-methylpyrrole-2-carboxamide
CID 83030008
4-[[(2R)-2-hydroxypropyl]sulfamoyl]-1-methylpyrrole-2-carboxylic acid
CID 93081616
4-[(2-hydroxy-4-methylpentyl)sulfamoyl]-1-methylpyrrole-2-carboxamide
CID 103834466
3-[(5-carbamoyl-1-methylpyrrol-3-yl)sulfonylamino]-2-methylpropanoic acid
CID 62674475
4-[(2-amino-2-cyclopropylethyl)sulfamoyl]-1-methylpyrrole-2-carboxamide
CID 115301253
4-[(2-amino-2-methylpropyl)sulfamoyl]-1-methylpyrrole-2-carboxamide;hydrochloride
CID 119988182
1-methyl-4-[2-(methylamino)ethylsulfamoyl]pyrrole-2-carboxamide;hydrochloride
CID 119973057
5-[(5-carbamoyl-1-methylpyrrol-3-yl)sulfonylamino]-2-methylpentanoic acid
CID 104682888
(2R)-2-[(5-carbamoyl-1-methylpyrrol-3-yl)sulfonylamino]-3-methylbutanoic acid
CID 79010821
(2S)-2-[(5-carbamoyl-1-methylpyrrol-3-yl)sulfonylamino]-3-hydroxypropanoic acid
CID 61142375
4-[(3-amino-2,2-difluoropropyl)sulfamoyl]-1-methylpyrrole-2-carboxamide
CID 114383910
4-[[4-(methanesulfonamido)phenyl]sulfamoyl]-1-methylpyrrole-2-carboxamide
CID 55573254

Frequently Asked Questions

What is the IUPAC name of 4-(2-hydroxypropylsulfamoyl)-1-methylpyrrole-2-carboxamide?
The IUPAC name of 4-(2-hydroxypropylsulfamoyl)-1-methylpyrrole-2-carboxamide (CID 43502336) is 4-(2-hydroxypropylsulfamoyl)-1-methylpyrrole-2-carboxamide.
What is the SMILES notation for 4-(2-hydroxypropylsulfamoyl)-1-methylpyrrole-2-carboxamide?
The canonical SMILES for 4-(2-hydroxypropylsulfamoyl)-1-methylpyrrole-2-carboxamide is CC(O)CNS(=O)(=O)c1cc(C(N)=O)n(C)c1.
What is the InChIKey of 4-(2-hydroxypropylsulfamoyl)-1-methylpyrrole-2-carboxamide?
The InChIKey is GPFPPRDQIVITQD-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H15N3O4S/c1-6(13)4-11-17(15,16)7-3-8(9(10)14)12(2)5-7/h3,5-6,11,13H,4H2,1-2H3,(H2,10,14).
What are the key properties of 4-(2-hydroxypropylsulfamoyl)-1-methylpyrrole-2-carboxamide?
4-(2-hydroxypropylsulfamoyl)-1-methylpyrrole-2-carboxamide has a molecular weight of 261.30 g/mol, XLogP of -1.22, 5 rotatable bonds, 3 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 4-(2-hydroxypropylsulfamoyl)-1-methylpyrrole-2-carboxamide is sourced from PubChem (CID 43502336), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).