N-[4-(propylsulfonylamino)phenyl]morpholine-3-carboxamide

C14H21N3O4S — CID 119754209

IUPACN-[4-(propylsulfonylamino)phenyl]morpholine-3-carboxamide
SMILESCCCS(=O)(=O)Nc1ccc(NC(=O)C2COCCN2)cc1
InChIInChI=1S/C14H21N3O4S/c1-2-9-22(19,20)17-12-5-3-11(4-6-12)16-14(18)13-10-21-8-7-15-13/h3-6,13,15,17H,2,7-10H2,1H3,(H,16,18)
InChIKeyDHJSNEGMYMKILJ-UHFFFAOYSA-N
MW327.41 g/mol
LogP0.77
Rot. Bonds6

About N-[4-(propylsulfonylamino)phenyl]morpholine-3-carboxamide

N-[4-(propylsulfonylamino)phenyl]morpholine-3-carboxamide (PubChem CID 119754209) has the molecular formula C14H21N3O4S and a molecular weight of 327.41 g/mol. Its IUPAC name is N-[4-(propylsulfonylamino)phenyl]morpholine-3-carboxamide.

Molecular Properties

Compound NameN-[4-(propylsulfonylamino)phenyl]morpholine-3-carboxamide
PubChem CID119754209
Molecular FormulaC14H21N3O4S
Molecular Weight327.41 g/mol
Exact Mass327.13
IUPAC NameN-[4-(propylsulfonylamino)phenyl]morpholine-3-carboxamide
SMILESCCCS(=O)(=O)Nc1ccc(NC(=O)C2COCCN2)cc1
InChIInChI=1S/C14H21N3O4S/c1-2-9-22(19,20)17-12-5-3-11(4-6-12)16-14(18)13-10-21-8-7-15-13/h3-6,13,15,17H,2,7-10H2,1H3,(H,16,18)
InChIKeyDHJSNEGMYMKILJ-UHFFFAOYSA-N
XLogP0.77
TPSA96.53 Ų
H-Bond Donors3
H-Bond Acceptors5
Rotatable Bonds6
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500327.41
LogP ≤ 50.77
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 105

Analyze N-[4-(propylsulfonylamino)phenyl]morpholine-3-carboxamide with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

N-[4-(ethylcarbamoyl)phenyl]morpholine-3-carboxamide;hydrochloride
CID 119714110
N-[4-(2-methylpropyl)phenyl]morpholine-3-carboxamide
CID 115177537
ethyl 4-(morpholine-3-carbonylamino)benzoate;hydrochloride
CID 119672431
N-[4-(2-methylpropanoylamino)phenyl]morpholine-3-carboxamide;hydrochloride
CID 119685241
N-[4-(ethylsulfonylamino)phenyl]pyrrolidine-2-carboxamide
CID 60946168
N-[4-(cyclopropylcarbamoylamino)phenyl]morpholine-3-carboxamide;hydrochloride
CID 119702443
N-[4-(ethylsulfonylamino)phenyl]pyrrolidine-2-carboxamide;hydrochloride
CID 119282547
N-(3,4-dimethylphenyl)morpholine-3-carboxamide;hydrochloride
CID 119670622
N-(3-ethyl-4-methoxyphenyl)morpholine-3-carboxamide
CID 115177545
(3R)-N-[4-(3-methylbutoxy)phenyl]morpholine-3-carboxamide
CID 124595367
N-[4-chloro-3-(diethylsulfamoyl)phenyl]morpholine-3-carboxamide;hydrochloride
CID 119679883
N-[4-methyl-3-(phenylsulfamoyl)phenyl]morpholine-3-carboxamide
CID 119730948

Frequently Asked Questions

What is the IUPAC name of N-[4-(propylsulfonylamino)phenyl]morpholine-3-carboxamide?
The IUPAC name of N-[4-(propylsulfonylamino)phenyl]morpholine-3-carboxamide (CID 119754209) is N-[4-(propylsulfonylamino)phenyl]morpholine-3-carboxamide.
What is the SMILES notation for N-[4-(propylsulfonylamino)phenyl]morpholine-3-carboxamide?
The canonical SMILES for N-[4-(propylsulfonylamino)phenyl]morpholine-3-carboxamide is CCCS(=O)(=O)Nc1ccc(NC(=O)C2COCCN2)cc1.
What is the InChIKey of N-[4-(propylsulfonylamino)phenyl]morpholine-3-carboxamide?
The InChIKey is DHJSNEGMYMKILJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H21N3O4S/c1-2-9-22(19,20)17-12-5-3-11(4-6-12)16-14(18)13-10-21-8-7-15-13/h3-6,13,15,17H,2,7-10H2,1H3,(H,16,18).
What are the key properties of N-[4-(propylsulfonylamino)phenyl]morpholine-3-carboxamide?
N-[4-(propylsulfonylamino)phenyl]morpholine-3-carboxamide has a molecular weight of 327.41 g/mol, XLogP of 0.77, 6 rotatable bonds, 3 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N-[4-(propylsulfonylamino)phenyl]morpholine-3-carboxamide is sourced from PubChem (CID 119754209), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).