3-(diethylsulfamoyl)-4-methyl-N-piperidin-4-yl-N-propylbenzamide;hydrochloride

C20H34ClN3O3S — CID 119825801

IUPAC3-(diethylsulfamoyl)-4-methyl-N-piperidin-4-yl-N-propylbenzamide;hydrochloride
SMILESCCCN(C(=O)c1ccc(C)c(S(=O)(=O)N(CC)CC)c1)C1CCNCC1.Cl
InChIInChI=1S/C20H33N3O3S.ClH/c1-5-14-23(18-10-12-21-13-11-18)20(24)17-9-8-16(4)19(15-17)27(25,26)22(6-2)7-3;/h8-9,15,18,21H,5-7,10-14H2,1-4H3;1H
InChIKeyOFZDMGUNZVCFPL-UHFFFAOYSA-N
MW432.03 g/mol
LogP3.05
Rot. Bonds8

About 3-(diethylsulfamoyl)-4-methyl-N-piperidin-4-yl-N-propylbenzamide;hydrochloride

3-(diethylsulfamoyl)-4-methyl-N-piperidin-4-yl-N-propylbenzamide;hydrochloride (PubChem CID 119825801) has the molecular formula C20H34ClN3O3S and a molecular weight of 432.03 g/mol. Its IUPAC name is 3-(diethylsulfamoyl)-4-methyl-N-piperidin-4-yl-N-propylbenzamide;hydrochloride.

Molecular Properties

Compound Name3-(diethylsulfamoyl)-4-methyl-N-piperidin-4-yl-N-propylbenzamide;hydrochloride
PubChem CID119825801
Molecular FormulaC20H34ClN3O3S
Molecular Weight432.03 g/mol
Exact Mass431.20
IUPAC Name3-(diethylsulfamoyl)-4-methyl-N-piperidin-4-yl-N-propylbenzamide;hydrochloride
SMILESCCCN(C(=O)c1ccc(C)c(S(=O)(=O)N(CC)CC)c1)C1CCNCC1.Cl
InChIInChI=1S/C20H33N3O3S.ClH/c1-5-14-23(18-10-12-21-13-11-18)20(24)17-9-8-16(4)19(15-17)27(25,26)22(6-2)7-3;/h8-9,15,18,21H,5-7,10-14H2,1-4H3;1H
InChIKeyOFZDMGUNZVCFPL-UHFFFAOYSA-N
XLogP3.05
TPSA69.72 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds8
Heavy Atoms28
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500432.03
LogP ≤ 53.05
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

3-(diethylsulfamoyl)-4-methyl-N-piperidin-4-ylbenzamide;hydrochloride
CID 119389715
3-methoxy-4-methyl-N-piperidin-4-yl-N-propylbenzamide;hydrochloride
CID 119823113
4-(diethylsulfamoyl)-N-propyl-N-pyrrolidin-3-ylbenzamide
CID 119531585
3-(diethylsulfamoyl)-N-[(3R)-1,1-dioxothiolan-3-yl]-N-ethyl-4-methylbenzamide
CID 97028486
3,5-dimethyl-N-piperidin-4-yl-N-propylbenzamide;hydrochloride
CID 119824323
3-methyl-4-nitro-N-piperidin-4-yl-N-propylbenzamide;hydrochloride
CID 119824847
4-ethyl-N-piperidin-4-yl-N-propylbenzamide;hydrochloride
CID 119823008
4-iodo-N-piperidin-4-yl-N-propylbenzamide;hydrochloride
CID 119822992
3-(diethylsulfamoyl)-4-methyl-N-(2-pyrrolidin-3-ylethyl)benzamide
CID 119537403
3-(cyclopropylsulfamoyl)-4-methoxy-N-piperidin-4-yl-N-propylbenzamide;hydrochloride
CID 119824864
4-(tert-butylsulfamoyl)-N-piperidin-4-yl-N-propylbenzamide;hydrochloride
CID 119823590
N-(azetidin-3-yl)-3,4-dimethyl-N-propylbenzamide
CID 66215454

Frequently Asked Questions

What is the IUPAC name of 3-(diethylsulfamoyl)-4-methyl-N-piperidin-4-yl-N-propylbenzamide;hydrochloride?
The IUPAC name of 3-(diethylsulfamoyl)-4-methyl-N-piperidin-4-yl-N-propylbenzamide;hydrochloride (CID 119825801) is 3-(diethylsulfamoyl)-4-methyl-N-piperidin-4-yl-N-propylbenzamide;hydrochloride.
What is the SMILES notation for 3-(diethylsulfamoyl)-4-methyl-N-piperidin-4-yl-N-propylbenzamide;hydrochloride?
The canonical SMILES for 3-(diethylsulfamoyl)-4-methyl-N-piperidin-4-yl-N-propylbenzamide;hydrochloride is CCCN(C(=O)c1ccc(C)c(S(=O)(=O)N(CC)CC)c1)C1CCNCC1.Cl.
What is the InChIKey of 3-(diethylsulfamoyl)-4-methyl-N-piperidin-4-yl-N-propylbenzamide;hydrochloride?
The InChIKey is OFZDMGUNZVCFPL-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H33N3O3S.ClH/c1-5-14-23(18-10-12-21-13-11-18)20(24)17-9-8-16(4)19(15-17)27(25,26)22(6-2)7-3;/h8-9,15,18,21H,5-7,10-14H2,1-4H3;1H.
What are the key properties of 3-(diethylsulfamoyl)-4-methyl-N-piperidin-4-yl-N-propylbenzamide;hydrochloride?
3-(diethylsulfamoyl)-4-methyl-N-piperidin-4-yl-N-propylbenzamide;hydrochloride has a molecular weight of 432.03 g/mol, XLogP of 3.05, 8 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 3-(diethylsulfamoyl)-4-methyl-N-piperidin-4-yl-N-propylbenzamide;hydrochloride is sourced from PubChem (CID 119825801), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).