N-(4-methyl-3-sulfamoylphenyl)morpholine-4-carboxamide

C12H17N3O4S — CID 78993692

IUPACN-(4-methyl-3-sulfamoylphenyl)morpholine-4-carboxamide
SMILESCc1ccc(NC(=O)N2CCOCC2)cc1S(N)(=O)=O
InChIInChI=1S/C12H17N3O4S/c1-9-2-3-10(8-11(9)20(13,17)18)14-12(16)15-4-6-19-7-5-15/h2-3,8H,4-7H2,1H3,(H,14,16)(H2,13,17,18)
InChIKeyIYEUHVDVUKRJDM-UHFFFAOYSA-N
MW299.35 g/mol
LogP0.51
Rot. Bonds2

About N-(4-methyl-3-sulfamoylphenyl)morpholine-4-carboxamide

N-(4-methyl-3-sulfamoylphenyl)morpholine-4-carboxamide (PubChem CID 78993692) has the molecular formula C12H17N3O4S and a molecular weight of 299.35 g/mol. Its IUPAC name is N-(4-methyl-3-sulfamoylphenyl)morpholine-4-carboxamide.

Molecular Properties

Compound NameN-(4-methyl-3-sulfamoylphenyl)morpholine-4-carboxamide
PubChem CID78993692
Molecular FormulaC12H17N3O4S
Molecular Weight299.35 g/mol
Exact Mass299.09
IUPAC NameN-(4-methyl-3-sulfamoylphenyl)morpholine-4-carboxamide
SMILESCc1ccc(NC(=O)N2CCOCC2)cc1S(N)(=O)=O
InChIInChI=1S/C12H17N3O4S/c1-9-2-3-10(8-11(9)20(13,17)18)14-12(16)15-4-6-19-7-5-15/h2-3,8H,4-7H2,1H3,(H,14,16)(H2,13,17,18)
InChIKeyIYEUHVDVUKRJDM-UHFFFAOYSA-N
XLogP0.51
TPSA101.73 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds2
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500299.35
LogP ≤ 50.51
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Related Compounds

4-N-(4-methyl-3-sulfamoylphenyl)-1-N-phenylpiperidine-1,4-dicarboxamide
CID 55363749
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CID 47041767
N-(4-methoxy-3-methylphenyl)morpholine-4-carboxamide
CID 47322511
N-[3-(morpholine-4-carbonylamino)phenyl]morpholine-4-carboxamide
CID 171576986
N-(1-methyl-4-sulfamoylpyrazol-3-yl)morpholine-4-carboxamide
CID 79152077
4-(aminomethyl)-N-(4-methyl-3-sulfamoylphenyl)oxane-4-carboxamide
CID 120919382
2-amino-N-(4-methyl-3-sulfamoylphenyl)-2-(oxan-4-yl)acetamide;hydrochloride
CID 120784349
N-(4-methyl-3-sulfamoylphenyl)-2-(4-morpholin-4-ylsulfonylphenoxy)acetamide
CID 30835139
N-(4-ethoxy-3-methylphenyl)morpholine-4-carboxamide
CID 47410728
(4-methyl-3-morpholin-4-ylsulfonylphenyl)thiourea
CID 169358512
N-(3-acetamidophenyl)morpholine-4-carboxamide
CID 3707113
N-(3,4-dimethylphenyl)-4-(2-morpholin-4-ylphenyl)piperazine-1-carboxamide
CID 113111700

Frequently Asked Questions

What is the IUPAC name of N-(4-methyl-3-sulfamoylphenyl)morpholine-4-carboxamide?
The IUPAC name of N-(4-methyl-3-sulfamoylphenyl)morpholine-4-carboxamide (CID 78993692) is N-(4-methyl-3-sulfamoylphenyl)morpholine-4-carboxamide.
What is the SMILES notation for N-(4-methyl-3-sulfamoylphenyl)morpholine-4-carboxamide?
The canonical SMILES for N-(4-methyl-3-sulfamoylphenyl)morpholine-4-carboxamide is Cc1ccc(NC(=O)N2CCOCC2)cc1S(N)(=O)=O.
What is the InChIKey of N-(4-methyl-3-sulfamoylphenyl)morpholine-4-carboxamide?
The InChIKey is IYEUHVDVUKRJDM-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H17N3O4S/c1-9-2-3-10(8-11(9)20(13,17)18)14-12(16)15-4-6-19-7-5-15/h2-3,8H,4-7H2,1H3,(H,14,16)(H2,13,17,18).
What are the key properties of N-(4-methyl-3-sulfamoylphenyl)morpholine-4-carboxamide?
N-(4-methyl-3-sulfamoylphenyl)morpholine-4-carboxamide has a molecular weight of 299.35 g/mol, XLogP of 0.51, 2 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-(4-methyl-3-sulfamoylphenyl)morpholine-4-carboxamide is sourced from PubChem (CID 78993692), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).