N-(2-piperidin-3-ylethyl)-3-(sulfamoylmethyl)benzamide;hydrochloride

C15H24ClN3O3S — CID 119555848

IUPACN-(2-piperidin-3-ylethyl)-3-(sulfamoylmethyl)benzamide;hydrochloride
SMILESCl.NS(=O)(=O)Cc1cccc(C(=O)NCCC2CCCNC2)c1
InChIInChI=1S/C15H23N3O3S.ClH/c16-22(20,21)11-13-3-1-5-14(9-13)15(19)18-8-6-12-4-2-7-17-10-12;/h1,3,5,9,12,17H,2,4,6-8,10-11H2,(H,18,19)(H2,16,20,21);1H
InChIKeyGNTCAQKBFKXMQE-UHFFFAOYSA-N
MW361.90 g/mol
LogP1.02
Rot. Bonds6

About N-(2-piperidin-3-ylethyl)-3-(sulfamoylmethyl)benzamide;hydrochloride

N-(2-piperidin-3-ylethyl)-3-(sulfamoylmethyl)benzamide;hydrochloride (PubChem CID 119555848) has the molecular formula C15H24ClN3O3S and a molecular weight of 361.90 g/mol. Its IUPAC name is N-(2-piperidin-3-ylethyl)-3-(sulfamoylmethyl)benzamide;hydrochloride.

Molecular Properties

Compound NameN-(2-piperidin-3-ylethyl)-3-(sulfamoylmethyl)benzamide;hydrochloride
PubChem CID119555848
Molecular FormulaC15H24ClN3O3S
Molecular Weight361.90 g/mol
Exact Mass361.12
IUPAC NameN-(2-piperidin-3-ylethyl)-3-(sulfamoylmethyl)benzamide;hydrochloride
SMILESCl.NS(=O)(=O)Cc1cccc(C(=O)NCCC2CCCNC2)c1
InChIInChI=1S/C15H23N3O3S.ClH/c16-22(20,21)11-13-3-1-5-14(9-13)15(19)18-8-6-12-4-2-7-17-10-12;/h1,3,5,9,12,17H,2,4,6-8,10-11H2,(H,18,19)(H2,16,20,21);1H
InChIKeyGNTCAQKBFKXMQE-UHFFFAOYSA-N
XLogP1.02
TPSA101.29 Ų
H-Bond Donors3
H-Bond Acceptors4
Rotatable Bonds6
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500361.90
LogP ≤ 51.02
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 104

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Related Compounds

3-(benzenesulfonylmethyl)-N-(2-piperidin-3-ylethyl)benzamide;hydrochloride
CID 119559372
3-iodo-N-(2-piperidin-3-ylethyl)benzamide;hydrochloride
CID 119555518
1-N-methyl-3-N-(2-piperidin-3-ylethyl)benzene-1,3-dicarboxamide
CID 119559534
3-chloro-N-(2-piperidin-3-ylethyl)benzamide
CID 63628186
3-(cyclopropylmethylsulfamoyl)-N-(2-piperidin-3-ylethyl)benzamide
CID 119558611
3-(difluoromethoxy)-N-(2-piperidin-3-ylethyl)benzamide;hydrochloride
CID 119555759
3-nitro-N-(2-piperidin-3-ylethyl)benzamide
CID 63628022
4-iodo-N-(2-piperidin-3-ylethyl)benzamide;hydrochloride
CID 119554925
3-methyl-N-(2-pyrrolidin-3-ylethyl)benzamide;hydrochloride
CID 119536491
2-oxo-N-(2-piperidin-3-ylethyl)-1H-pyridine-4-carboxamide
CID 103806761
3-(dimethylcarbamoylamino)-N-(2-piperidin-3-ylethyl)benzamide
CID 119558110
2,6-difluoro-N-(2-piperidin-3-ylethyl)benzamide;hydrochloride
CID 119554934

Frequently Asked Questions

What is the IUPAC name of N-(2-piperidin-3-ylethyl)-3-(sulfamoylmethyl)benzamide;hydrochloride?
The IUPAC name of N-(2-piperidin-3-ylethyl)-3-(sulfamoylmethyl)benzamide;hydrochloride (CID 119555848) is N-(2-piperidin-3-ylethyl)-3-(sulfamoylmethyl)benzamide;hydrochloride.
What is the SMILES notation for N-(2-piperidin-3-ylethyl)-3-(sulfamoylmethyl)benzamide;hydrochloride?
The canonical SMILES for N-(2-piperidin-3-ylethyl)-3-(sulfamoylmethyl)benzamide;hydrochloride is Cl.NS(=O)(=O)Cc1cccc(C(=O)NCCC2CCCNC2)c1.
What is the InChIKey of N-(2-piperidin-3-ylethyl)-3-(sulfamoylmethyl)benzamide;hydrochloride?
The InChIKey is GNTCAQKBFKXMQE-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H23N3O3S.ClH/c16-22(20,21)11-13-3-1-5-14(9-13)15(19)18-8-6-12-4-2-7-17-10-12;/h1,3,5,9,12,17H,2,4,6-8,10-11H2,(H,18,19)(H2,16,20,21);1H.
What are the key properties of N-(2-piperidin-3-ylethyl)-3-(sulfamoylmethyl)benzamide;hydrochloride?
N-(2-piperidin-3-ylethyl)-3-(sulfamoylmethyl)benzamide;hydrochloride has a molecular weight of 361.90 g/mol, XLogP of 1.02, 6 rotatable bonds, 3 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2-piperidin-3-ylethyl)-3-(sulfamoylmethyl)benzamide;hydrochloride is sourced from PubChem (CID 119555848), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).