N-[4-chloro-3-(diethylsulfamoyl)phenyl]morpholine-3-carboxamide;hydrochloride

C15H23Cl2N3O4S — CID 119679883

IUPACN-[4-chloro-3-(diethylsulfamoyl)phenyl]morpholine-3-carboxamide;hydrochloride
SMILESCCN(CC)S(=O)(=O)c1cc(NC(=O)C2COCCN2)ccc1Cl.Cl
InChIInChI=1S/C15H22ClN3O4S.ClH/c1-3-19(4-2)24(21,22)14-9-11(5-6-12(14)16)18-15(20)13-10-23-8-7-17-13;/h5-6,9,13,17H,3-4,7-8,10H2,1-2H3,(H,18,20);1H
InChIKeyIYBGGWKFUMVCJV-UHFFFAOYSA-N
MW412.34 g/mol
LogP1.72
Rot. Bonds6

About N-[4-chloro-3-(diethylsulfamoyl)phenyl]morpholine-3-carboxamide;hydrochloride

N-[4-chloro-3-(diethylsulfamoyl)phenyl]morpholine-3-carboxamide;hydrochloride (PubChem CID 119679883) has the molecular formula C15H23Cl2N3O4S and a molecular weight of 412.34 g/mol. Its IUPAC name is N-[4-chloro-3-(diethylsulfamoyl)phenyl]morpholine-3-carboxamide;hydrochloride.

Molecular Properties

Compound NameN-[4-chloro-3-(diethylsulfamoyl)phenyl]morpholine-3-carboxamide;hydrochloride
PubChem CID119679883
Molecular FormulaC15H23Cl2N3O4S
Molecular Weight412.34 g/mol
Exact Mass411.08
IUPAC NameN-[4-chloro-3-(diethylsulfamoyl)phenyl]morpholine-3-carboxamide;hydrochloride
SMILESCCN(CC)S(=O)(=O)c1cc(NC(=O)C2COCCN2)ccc1Cl.Cl
InChIInChI=1S/C15H22ClN3O4S.ClH/c1-3-19(4-2)24(21,22)14-9-11(5-6-12(14)16)18-15(20)13-10-23-8-7-17-13;/h5-6,9,13,17H,3-4,7-8,10H2,1-2H3,(H,18,20);1H
InChIKeyIYBGGWKFUMVCJV-UHFFFAOYSA-N
XLogP1.72
TPSA87.74 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds6
Heavy Atoms25
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500412.34
LogP ≤ 51.72
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

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Related Compounds

N-[4-chloro-3-(diethylsulfamoyl)phenyl]piperidine-2-carboxamide;hydrochloride
CID 119266222
N-(3,4-dimethylphenyl)morpholine-3-carboxamide;hydrochloride
CID 119670622
N-[4-chloro-3-(diethylsulfamoyl)phenyl]cyclohex-3-ene-1-carboxamide
CID 51154870
N-[4-(propylsulfonylamino)phenyl]morpholine-3-carboxamide
CID 119754209
methyl 2-chloro-4-(morpholine-3-carbonylamino)benzoate
CID 119794095
N-[3-(azepan-1-ylsulfonyl)-4-methylphenyl]morpholine-3-carboxamide
CID 119675117
N-(4-ethoxy-3-piperidin-1-ylsulfonylphenyl)morpholine-3-carboxamide
CID 119688738
N-[4-methyl-3-(phenylsulfamoyl)phenyl]morpholine-3-carboxamide
CID 119730948
N-(3,4-dimethoxyphenyl)morpholine-3-carboxamide;hydrochloride
CID 119673632
N-(3-ethyl-4-methoxyphenyl)morpholine-3-carboxamide
CID 115177545
N-[3-(cyclopropanecarbonylamino)phenyl]morpholine-3-carboxamide;hydrochloride
CID 119710451
N-(3-methylphenyl)morpholine-3-carboxamide;hydrochloride
CID 119670415

Frequently Asked Questions

What is the IUPAC name of N-[4-chloro-3-(diethylsulfamoyl)phenyl]morpholine-3-carboxamide;hydrochloride?
The IUPAC name of N-[4-chloro-3-(diethylsulfamoyl)phenyl]morpholine-3-carboxamide;hydrochloride (CID 119679883) is N-[4-chloro-3-(diethylsulfamoyl)phenyl]morpholine-3-carboxamide;hydrochloride.
What is the SMILES notation for N-[4-chloro-3-(diethylsulfamoyl)phenyl]morpholine-3-carboxamide;hydrochloride?
The canonical SMILES for N-[4-chloro-3-(diethylsulfamoyl)phenyl]morpholine-3-carboxamide;hydrochloride is CCN(CC)S(=O)(=O)c1cc(NC(=O)C2COCCN2)ccc1Cl.Cl.
What is the InChIKey of N-[4-chloro-3-(diethylsulfamoyl)phenyl]morpholine-3-carboxamide;hydrochloride?
The InChIKey is IYBGGWKFUMVCJV-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H22ClN3O4S.ClH/c1-3-19(4-2)24(21,22)14-9-11(5-6-12(14)16)18-15(20)13-10-23-8-7-17-13;/h5-6,9,13,17H,3-4,7-8,10H2,1-2H3,(H,18,20);1H.
What are the key properties of N-[4-chloro-3-(diethylsulfamoyl)phenyl]morpholine-3-carboxamide;hydrochloride?
N-[4-chloro-3-(diethylsulfamoyl)phenyl]morpholine-3-carboxamide;hydrochloride has a molecular weight of 412.34 g/mol, XLogP of 1.72, 6 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N-[4-chloro-3-(diethylsulfamoyl)phenyl]morpholine-3-carboxamide;hydrochloride is sourced from PubChem (CID 119679883), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).