1-cyclobutyl-N-ethyl-4-sulfamoylpyrrole-2-carboxamide

C11H17N3O3S — CID 114611983

IUPAC1-cyclobutyl-N-ethyl-4-sulfamoylpyrrole-2-carboxamide
SMILESCCNC(=O)c1cc(S(N)(=O)=O)cn1C1CCC1
InChIInChI=1S/C11H17N3O3S/c1-2-13-11(15)10-6-9(18(12,16)17)7-14(10)8-4-3-5-8/h6-8H,2-5H2,1H3,(H,13,15)(H2,12,16,17)
InChIKeyDYBDIMPSXAVTLJ-UHFFFAOYSA-N
MW271.34 g/mol
LogP0.61
Rot. Bonds4

About 1-cyclobutyl-N-ethyl-4-sulfamoylpyrrole-2-carboxamide

1-cyclobutyl-N-ethyl-4-sulfamoylpyrrole-2-carboxamide (PubChem CID 114611983) has the molecular formula C11H17N3O3S and a molecular weight of 271.34 g/mol. Its IUPAC name is 1-cyclobutyl-N-ethyl-4-sulfamoylpyrrole-2-carboxamide.

Molecular Properties

Compound Name1-cyclobutyl-N-ethyl-4-sulfamoylpyrrole-2-carboxamide
PubChem CID114611983
Molecular FormulaC11H17N3O3S
Molecular Weight271.34 g/mol
Exact Mass271.10
IUPAC Name1-cyclobutyl-N-ethyl-4-sulfamoylpyrrole-2-carboxamide
SMILESCCNC(=O)c1cc(S(N)(=O)=O)cn1C1CCC1
InChIInChI=1S/C11H17N3O3S/c1-2-13-11(15)10-6-9(18(12,16)17)7-14(10)8-4-3-5-8/h6-8H,2-5H2,1H3,(H,13,15)(H2,12,16,17)
InChIKeyDYBDIMPSXAVTLJ-UHFFFAOYSA-N
XLogP0.61
TPSA94.19 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500271.34
LogP ≤ 50.61
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Related Compounds

methyl 1-cyclobutyl-4-sulfamoylpyrrole-2-carboxylate
CID 114612607
N-(cyclopentylmethyl)-1-cyclopropyl-4-sulfamoylpyrrole-2-carboxamide
CID 114612168
1-cyclobutyl-4-sulfamoylpyrrole-2-carboxylic acid
CID 114612783
1-cyclopropyl-N-methyl-4-sulfamoylpyrrole-2-carboxamide
CID 114611999
1-cyclopropyl-N-(3-methylbutyl)-4-sulfamoylpyrrole-2-carboxamide
CID 114611971
methyl 1-cyclopentyl-4-sulfamoylpyrrole-2-carboxylate
CID 114612610
1-cyclobutyl-5-(2-methylpropylcarbamoyl)pyrrole-3-sulfonyl chloride
CID 114610992
1-cyclopropyl-N-methyl-N-(2-methylbutan-2-yl)-4-sulfamoylpyrrole-2-carboxamide
CID 114612371
1-cyclopropyl-4-sulfamoylpyrrole-2-carboxamide
CID 114612010
1-cyclopropyl-N-propan-2-yl-N-propyl-4-sulfamoylpyrrole-2-carboxamide
CID 114612118
1-cyclopropyl-5-(propylcarbamoyl)pyrrole-3-sulfonyl chloride
CID 114610909
N-cyclopropyl-1-piperidin-4-yl-4-sulfamoylpyrrole-2-carboxamide
CID 114611940

Frequently Asked Questions

What is the IUPAC name of 1-cyclobutyl-N-ethyl-4-sulfamoylpyrrole-2-carboxamide?
The IUPAC name of 1-cyclobutyl-N-ethyl-4-sulfamoylpyrrole-2-carboxamide (CID 114611983) is 1-cyclobutyl-N-ethyl-4-sulfamoylpyrrole-2-carboxamide.
What is the SMILES notation for 1-cyclobutyl-N-ethyl-4-sulfamoylpyrrole-2-carboxamide?
The canonical SMILES for 1-cyclobutyl-N-ethyl-4-sulfamoylpyrrole-2-carboxamide is CCNC(=O)c1cc(S(N)(=O)=O)cn1C1CCC1.
What is the InChIKey of 1-cyclobutyl-N-ethyl-4-sulfamoylpyrrole-2-carboxamide?
The InChIKey is DYBDIMPSXAVTLJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H17N3O3S/c1-2-13-11(15)10-6-9(18(12,16)17)7-14(10)8-4-3-5-8/h6-8H,2-5H2,1H3,(H,13,15)(H2,12,16,17).
What are the key properties of 1-cyclobutyl-N-ethyl-4-sulfamoylpyrrole-2-carboxamide?
1-cyclobutyl-N-ethyl-4-sulfamoylpyrrole-2-carboxamide has a molecular weight of 271.34 g/mol, XLogP of 0.61, 4 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 1-cyclobutyl-N-ethyl-4-sulfamoylpyrrole-2-carboxamide is sourced from PubChem (CID 114611983), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).