4-[(5-bromopyrazin-2-yl)sulfamoyl]-1-methylpyrrole-2-carboxamide

C10H10BrN5O3S — CID 115733506

IUPAC4-[(5-bromopyrazin-2-yl)sulfamoyl]-1-methylpyrrole-2-carboxamide
SMILESCn1cc(S(=O)(=O)Nc2cnc(Br)cn2)cc1C(N)=O
InChIInChI=1S/C10H10BrN5O3S/c1-16-5-6(2-7(16)10(12)17)20(18,19)15-9-4-13-8(11)3-14-9/h2-5H,1H3,(H2,12,17)(H,14,15)
InChIKeyLSGZQOXVRUIVSY-UHFFFAOYSA-N
MW360.19 g/mol
LogP0.48
Rot. Bonds4

About 4-[(5-bromopyrazin-2-yl)sulfamoyl]-1-methylpyrrole-2-carboxamide

4-[(5-bromopyrazin-2-yl)sulfamoyl]-1-methylpyrrole-2-carboxamide (PubChem CID 115733506) has the molecular formula C10H10BrN5O3S and a molecular weight of 360.19 g/mol. Its IUPAC name is 4-[(5-bromopyrazin-2-yl)sulfamoyl]-1-methylpyrrole-2-carboxamide.

Molecular Properties

Compound Name4-[(5-bromopyrazin-2-yl)sulfamoyl]-1-methylpyrrole-2-carboxamide
PubChem CID115733506
Molecular FormulaC10H10BrN5O3S
Molecular Weight360.19 g/mol
Exact Mass358.97
IUPAC Name4-[(5-bromopyrazin-2-yl)sulfamoyl]-1-methylpyrrole-2-carboxamide
SMILESCn1cc(S(=O)(=O)Nc2cnc(Br)cn2)cc1C(N)=O
InChIInChI=1S/C10H10BrN5O3S/c1-16-5-6(2-7(16)10(12)17)20(18,19)15-9-4-13-8(11)3-14-9/h2-5H,1H3,(H2,12,17)(H,14,15)
InChIKeyLSGZQOXVRUIVSY-UHFFFAOYSA-N
XLogP0.48
TPSA119.97 Ų
H-Bond Donors2
H-Bond Acceptors6
Rotatable Bonds4
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500360.19
LogP ≤ 50.48
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 106

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Related Compounds

4-[(2-chloropyrimidin-4-yl)sulfamoyl]-1-methylpyrrole-2-carboxamide
CID 116798901
4-[(5-bromo-4-methyl-2-pyridinyl)sulfamoyl]-1-methylpyrrole-2-carboxylic acid
CID 79735958
1-methyl-4-(1H-1,2,4-triazol-5-ylsulfamoyl)pyrrole-2-carboxamide
CID 62944648
4-[[4-(methanesulfonamido)phenyl]sulfamoyl]-1-methylpyrrole-2-carboxamide
CID 55573254
4-(2-hydroxypropylsulfamoyl)-1-methylpyrrole-2-carboxamide
CID 43502336
4-[[(2R)-2-hydroxypropyl]sulfamoyl]-1-methylpyrrole-2-carboxamide
CID 83030008
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
1-[[(5-carbamoyl-1-methylpyrrol-3-yl)sulfonylamino]methyl]cyclobutane-1-carboxylic acid
CID 115445410
4-[[1-(hydroxymethyl)cyclopentyl]methylsulfamoyl]-1-methylpyrrole-2-carboxamide
CID 115362903
1-methyl-4-[[4-(trifluoromethoxy)phenyl]sulfamoyl]pyrrole-2-carboxamide
CID 35507297
(2R)-2-[(5-carbamoyl-1-methylpyrrol-3-yl)sulfonylamino]-3-methylbutanoic acid
CID 79010821

Frequently Asked Questions

What is the IUPAC name of 4-[(5-bromopyrazin-2-yl)sulfamoyl]-1-methylpyrrole-2-carboxamide?
The IUPAC name of 4-[(5-bromopyrazin-2-yl)sulfamoyl]-1-methylpyrrole-2-carboxamide (CID 115733506) is 4-[(5-bromopyrazin-2-yl)sulfamoyl]-1-methylpyrrole-2-carboxamide.
What is the SMILES notation for 4-[(5-bromopyrazin-2-yl)sulfamoyl]-1-methylpyrrole-2-carboxamide?
The canonical SMILES for 4-[(5-bromopyrazin-2-yl)sulfamoyl]-1-methylpyrrole-2-carboxamide is Cn1cc(S(=O)(=O)Nc2cnc(Br)cn2)cc1C(N)=O.
What is the InChIKey of 4-[(5-bromopyrazin-2-yl)sulfamoyl]-1-methylpyrrole-2-carboxamide?
The InChIKey is LSGZQOXVRUIVSY-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H10BrN5O3S/c1-16-5-6(2-7(16)10(12)17)20(18,19)15-9-4-13-8(11)3-14-9/h2-5H,1H3,(H2,12,17)(H,14,15).
What are the key properties of 4-[(5-bromopyrazin-2-yl)sulfamoyl]-1-methylpyrrole-2-carboxamide?
4-[(5-bromopyrazin-2-yl)sulfamoyl]-1-methylpyrrole-2-carboxamide has a molecular weight of 360.19 g/mol, XLogP of 0.48, 4 rotatable bonds, 2 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 4-[(5-bromopyrazin-2-yl)sulfamoyl]-1-methylpyrrole-2-carboxamide is sourced from PubChem (CID 115733506), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).