N-[(2R)-2-hydroxypropyl]-1-methyl-4-sulfamoylpyrrole-2-carboxamide

C9H15N3O4S — CID 83032455

IUPACN-[(2R)-2-hydroxypropyl]-1-methyl-4-sulfamoylpyrrole-2-carboxamide
SMILESC[C@@H](O)CNC(=O)c1cc(S(N)(=O)=O)cn1C
InChIInChI=1S/C9H15N3O4S/c1-6(13)4-11-9(14)8-3-7(5-12(8)2)17(10,15)16/h3,5-6,13H,4H2,1-2H3,(H,11,14)(H2,10,15,16)/t6-/m1/s1
InChIKeyZVJUWGQBFPHBPU-ZCFIWIBFSA-N
MW261.30 g/mol
LogP-1.22
Rot. Bonds4

About N-[(2R)-2-hydroxypropyl]-1-methyl-4-sulfamoylpyrrole-2-carboxamide

N-[(2R)-2-hydroxypropyl]-1-methyl-4-sulfamoylpyrrole-2-carboxamide (PubChem CID 83032455) has the molecular formula C9H15N3O4S and a molecular weight of 261.30 g/mol. Its IUPAC name is N-[(2R)-2-hydroxypropyl]-1-methyl-4-sulfamoylpyrrole-2-carboxamide.

Molecular Properties

Compound NameN-[(2R)-2-hydroxypropyl]-1-methyl-4-sulfamoylpyrrole-2-carboxamide
PubChem CID83032455
Molecular FormulaC9H15N3O4S
Molecular Weight261.30 g/mol
Exact Mass261.08
IUPAC NameN-[(2R)-2-hydroxypropyl]-1-methyl-4-sulfamoylpyrrole-2-carboxamide
SMILESC[C@@H](O)CNC(=O)c1cc(S(N)(=O)=O)cn1C
InChIInChI=1S/C9H15N3O4S/c1-6(13)4-11-9(14)8-3-7(5-12(8)2)17(10,15)16/h3,5-6,13H,4H2,1-2H3,(H,11,14)(H2,10,15,16)/t6-/m1/s1
InChIKeyZVJUWGQBFPHBPU-ZCFIWIBFSA-N
XLogP-1.22
TPSA114.42 Ų
H-Bond Donors3
H-Bond Acceptors5
Rotatable Bonds4
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

N-(2,2-dimethylpropyl)-1-methyl-4-sulfamoylpyrrole-2-carboxamide
CID 61381311
3-methoxy-4-[(1-methyl-4-sulfamoylpyrrole-2-carbonyl)amino]butanoic acid
CID 103153124
2-[(1-methyl-4-sulfamoylpyrrole-2-carbonyl)amino]propanoic acid
CID 16779987
4-[(1-methyl-4-sulfamoylpyrrole-2-carbonyl)amino]butanoic acid
CID 16780234
1-methyl-N-(3-methylsulfonylpropyl)-4-sulfamoylpyrrole-2-carboxamide
CID 61149529
4-acetyl-N-[(2R)-2-hydroxypropyl]-1-methylpyrrole-2-carboxamide
CID 83039564
N-(2-ethoxyethyl)-1-methyl-4-sulfamoylpyrrole-2-carboxamide
CID 60977535
N-(1-methoxypropan-2-yl)-1-methyl-4-sulfamoylpyrrole-2-carboxamide
CID 60718274
4-(2-hydroxypropylsulfamoyl)-1-methylpyrrole-2-carboxamide
CID 43502336
4-[[(2R)-2-hydroxypropyl]sulfamoyl]-1-methylpyrrole-2-carboxamide
CID 83030008
N-(1-methoxy-3-methylbutan-2-yl)-1-methyl-4-sulfamoylpyrrole-2-carboxamide
CID 65381407
N-(4-methoxy-2,2-dimethylbutyl)-1-methyl-4-sulfamoylpyrrole-2-carboxamide
CID 104625478

Frequently Asked Questions

What is the IUPAC name of N-[(2R)-2-hydroxypropyl]-1-methyl-4-sulfamoylpyrrole-2-carboxamide?
The IUPAC name of N-[(2R)-2-hydroxypropyl]-1-methyl-4-sulfamoylpyrrole-2-carboxamide (CID 83032455) is N-[(2R)-2-hydroxypropyl]-1-methyl-4-sulfamoylpyrrole-2-carboxamide.
What is the SMILES notation for N-[(2R)-2-hydroxypropyl]-1-methyl-4-sulfamoylpyrrole-2-carboxamide?
The canonical SMILES for N-[(2R)-2-hydroxypropyl]-1-methyl-4-sulfamoylpyrrole-2-carboxamide is C[C@@H](O)CNC(=O)c1cc(S(N)(=O)=O)cn1C.
What is the InChIKey of N-[(2R)-2-hydroxypropyl]-1-methyl-4-sulfamoylpyrrole-2-carboxamide?
The InChIKey is ZVJUWGQBFPHBPU-ZCFIWIBFSA-N. The full InChI is InChI=1S/C9H15N3O4S/c1-6(13)4-11-9(14)8-3-7(5-12(8)2)17(10,15)16/h3,5-6,13H,4H2,1-2H3,(H,11,14)(H2,10,15,16)/t6-/m1/s1.
What are the key properties of N-[(2R)-2-hydroxypropyl]-1-methyl-4-sulfamoylpyrrole-2-carboxamide?
N-[(2R)-2-hydroxypropyl]-1-methyl-4-sulfamoylpyrrole-2-carboxamide has a molecular weight of 261.30 g/mol, XLogP of -1.22, 4 rotatable bonds, 3 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N-[(2R)-2-hydroxypropyl]-1-methyl-4-sulfamoylpyrrole-2-carboxamide is sourced from PubChem (CID 83032455), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).