N-[4-chloro-3-(diethylsulfamoyl)phenyl]piperidine-2-carboxamide;hydrochloride

C16H25Cl2N3O3S — CID 119266222

IUPACN-[4-chloro-3-(diethylsulfamoyl)phenyl]piperidine-2-carboxamide;hydrochloride
SMILESCCN(CC)S(=O)(=O)c1cc(NC(=O)C2CCCCN2)ccc1Cl.Cl
InChIInChI=1S/C16H24ClN3O3S.ClH/c1-3-20(4-2)24(22,23)15-11-12(8-9-13(15)17)19-16(21)14-7-5-6-10-18-14;/h8-9,11,14,18H,3-7,10H2,1-2H3,(H,19,21);1H
InChIKeyVFYODPQFPAIECY-UHFFFAOYSA-N
MW410.37 g/mol
LogP2.87
Rot. Bonds6

About N-[4-chloro-3-(diethylsulfamoyl)phenyl]piperidine-2-carboxamide;hydrochloride

N-[4-chloro-3-(diethylsulfamoyl)phenyl]piperidine-2-carboxamide;hydrochloride (PubChem CID 119266222) has the molecular formula C16H25Cl2N3O3S and a molecular weight of 410.37 g/mol. Its IUPAC name is N-[4-chloro-3-(diethylsulfamoyl)phenyl]piperidine-2-carboxamide;hydrochloride.

Molecular Properties

Compound NameN-[4-chloro-3-(diethylsulfamoyl)phenyl]piperidine-2-carboxamide;hydrochloride
PubChem CID119266222
Molecular FormulaC16H25Cl2N3O3S
Molecular Weight410.37 g/mol
Exact Mass409.10
IUPAC NameN-[4-chloro-3-(diethylsulfamoyl)phenyl]piperidine-2-carboxamide;hydrochloride
SMILESCCN(CC)S(=O)(=O)c1cc(NC(=O)C2CCCCN2)ccc1Cl.Cl
InChIInChI=1S/C16H24ClN3O3S.ClH/c1-3-20(4-2)24(22,23)15-11-12(8-9-13(15)17)19-16(21)14-7-5-6-10-18-14;/h8-9,11,14,18H,3-7,10H2,1-2H3,(H,19,21);1H
InChIKeyVFYODPQFPAIECY-UHFFFAOYSA-N
XLogP2.87
TPSA78.51 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds6
Heavy Atoms25
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500410.37
LogP ≤ 52.87
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Related Compounds

N-[4-chloro-3-(diethylsulfamoyl)phenyl]morpholine-3-carboxamide;hydrochloride
CID 119679883
N-(3,4-dichlorophenyl)piperidine-2-carboxamide;hydrochloride
CID 42943662
N-[4-chloro-3-(diethylsulfamoyl)phenyl]cyclohex-3-ene-1-carboxamide
CID 51154870
(2R)-N-[4-chloro-3-(dimethylcarbamoyl)phenyl]piperidine-2-carboxamide;hydrochloride
CID 119718954
N-(3-chloro-4-methylphenyl)piperidine-2-carboxamide;hydrochloride
CID 119262099
N-[3-chloro-4-(methanesulfonamido)phenyl]piperidine-2-carboxamide
CID 43711061
N-(4-chloro-3-methoxyphenyl)azepane-2-carboxamide
CID 107621689
2-(4-aminophenyl)-N-[4-chloro-3-(diethylsulfamoyl)phenyl]acetamide;hydrochloride
CID 119679885
(2R)-N-(3-chloro-4-ethoxyphenyl)piperidine-2-carboxamide
CID 93359932
N-(3-chloro-4-ethoxyphenyl)azepane-2-carboxamide
CID 64564595
2-(4-aminophenyl)-N-[4-chloro-3-(diethylsulfamoyl)phenyl]acetamide
CID 119679886
(2R)-N-(4-bromo-3-chlorophenyl)piperidine-2-carboxamide
CID 107620300

Frequently Asked Questions

What is the IUPAC name of N-[4-chloro-3-(diethylsulfamoyl)phenyl]piperidine-2-carboxamide;hydrochloride?
The IUPAC name of N-[4-chloro-3-(diethylsulfamoyl)phenyl]piperidine-2-carboxamide;hydrochloride (CID 119266222) is N-[4-chloro-3-(diethylsulfamoyl)phenyl]piperidine-2-carboxamide;hydrochloride.
What is the SMILES notation for N-[4-chloro-3-(diethylsulfamoyl)phenyl]piperidine-2-carboxamide;hydrochloride?
The canonical SMILES for N-[4-chloro-3-(diethylsulfamoyl)phenyl]piperidine-2-carboxamide;hydrochloride is CCN(CC)S(=O)(=O)c1cc(NC(=O)C2CCCCN2)ccc1Cl.Cl.
What is the InChIKey of N-[4-chloro-3-(diethylsulfamoyl)phenyl]piperidine-2-carboxamide;hydrochloride?
The InChIKey is VFYODPQFPAIECY-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H24ClN3O3S.ClH/c1-3-20(4-2)24(22,23)15-11-12(8-9-13(15)17)19-16(21)14-7-5-6-10-18-14;/h8-9,11,14,18H,3-7,10H2,1-2H3,(H,19,21);1H.
What are the key properties of N-[4-chloro-3-(diethylsulfamoyl)phenyl]piperidine-2-carboxamide;hydrochloride?
N-[4-chloro-3-(diethylsulfamoyl)phenyl]piperidine-2-carboxamide;hydrochloride has a molecular weight of 410.37 g/mol, XLogP of 2.87, 6 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-[4-chloro-3-(diethylsulfamoyl)phenyl]piperidine-2-carboxamide;hydrochloride is sourced from PubChem (CID 119266222), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).