N-(4-sulfamoylphenyl)thiomorpholine-3-carboxamide

C11H15N3O3S2 — CID 82905967

IUPACN-(4-sulfamoylphenyl)thiomorpholine-3-carboxamide
SMILESNS(=O)(=O)c1ccc(NC(=O)C2CSCCN2)cc1
InChIInChI=1S/C11H15N3O3S2/c12-19(16,17)9-3-1-8(2-4-9)14-11(15)10-7-18-6-5-13-10/h1-4,10,13H,5-7H2,(H,14,15)(H2,12,16,17)
InChIKeyFERPONZAQDUEHG-UHFFFAOYSA-N
MW301.39 g/mol
LogP-0.02
Rot. Bonds3

About N-(4-sulfamoylphenyl)thiomorpholine-3-carboxamide

N-(4-sulfamoylphenyl)thiomorpholine-3-carboxamide (PubChem CID 82905967) has the molecular formula C11H15N3O3S2 and a molecular weight of 301.39 g/mol. Its IUPAC name is N-(4-sulfamoylphenyl)thiomorpholine-3-carboxamide.

Molecular Properties

Compound NameN-(4-sulfamoylphenyl)thiomorpholine-3-carboxamide
PubChem CID82905967
Molecular FormulaC11H15N3O3S2
Molecular Weight301.39 g/mol
Exact Mass301.06
IUPAC NameN-(4-sulfamoylphenyl)thiomorpholine-3-carboxamide
SMILESNS(=O)(=O)c1ccc(NC(=O)C2CSCCN2)cc1
InChIInChI=1S/C11H15N3O3S2/c12-19(16,17)9-3-1-8(2-4-9)14-11(15)10-7-18-6-5-13-10/h1-4,10,13H,5-7H2,(H,14,15)(H2,12,16,17)
InChIKeyFERPONZAQDUEHG-UHFFFAOYSA-N
XLogP-0.02
TPSA101.29 Ų
H-Bond Donors3
H-Bond Acceptors5
Rotatable Bonds3
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500301.39
LogP ≤ 5-0.02
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 105

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Related Compounds

N-[4-(benzenesulfonyl)phenyl]thiomorpholine-3-carboxamide
CID 172895059
N-[4-(difluoromethylsulfonyl)phenyl]thiomorpholine-3-carboxamide
CID 82906170
N-[4-(carbamoylamino)phenyl]thiomorpholine-3-carboxamide
CID 82909460
N-(2-bromo-4-sulfamoylphenyl)thiomorpholine-3-carboxamide
CID 82908517
N-[3-(sulfamoylamino)phenyl]thiomorpholine-3-carboxamide
CID 82908775
N-(4-phenylphenyl)thiomorpholine-3-carboxamide
CID 82896691
N-(3,4-difluorophenyl)thiomorpholine-3-carboxamide
CID 82906459
N-(6-methyl-3-pyridinyl)thiomorpholine-3-carboxamide
CID 82917928
methyl 2-[4-(thiomorpholine-3-carbonylamino)phenoxy]acetate
CID 82906882
N-[4-(dimethylsulfamoyl)phenyl]-1,3-thiazolidine-4-carboxamide
CID 43702511
N-pyridin-3-ylthiomorpholine-3-carboxamide
CID 82905944
N-(3-methylphenyl)thiomorpholine-3-carboxamide
CID 82906077

Frequently Asked Questions

What is the IUPAC name of N-(4-sulfamoylphenyl)thiomorpholine-3-carboxamide?
The IUPAC name of N-(4-sulfamoylphenyl)thiomorpholine-3-carboxamide (CID 82905967) is N-(4-sulfamoylphenyl)thiomorpholine-3-carboxamide.
What is the SMILES notation for N-(4-sulfamoylphenyl)thiomorpholine-3-carboxamide?
The canonical SMILES for N-(4-sulfamoylphenyl)thiomorpholine-3-carboxamide is NS(=O)(=O)c1ccc(NC(=O)C2CSCCN2)cc1.
What is the InChIKey of N-(4-sulfamoylphenyl)thiomorpholine-3-carboxamide?
The InChIKey is FERPONZAQDUEHG-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H15N3O3S2/c12-19(16,17)9-3-1-8(2-4-9)14-11(15)10-7-18-6-5-13-10/h1-4,10,13H,5-7H2,(H,14,15)(H2,12,16,17).
What are the key properties of N-(4-sulfamoylphenyl)thiomorpholine-3-carboxamide?
N-(4-sulfamoylphenyl)thiomorpholine-3-carboxamide has a molecular weight of 301.39 g/mol, XLogP of -0.02, 3 rotatable bonds, 3 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N-(4-sulfamoylphenyl)thiomorpholine-3-carboxamide is sourced from PubChem (CID 82905967), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).