2-methoxy-5-[(4-methylpiperidin-4-yl)methylsulfamoyl]benzamide;hydrochloride

C15H24ClN3O4S — CID 120720413

IUPAC2-methoxy-5-[(4-methylpiperidin-4-yl)methylsulfamoyl]benzamide;hydrochloride
SMILESCOc1ccc(S(=O)(=O)NCC2(C)CCNCC2)cc1C(N)=O.Cl
InChIInChI=1S/C15H23N3O4S.ClH/c1-15(5-7-17-8-6-15)10-18-23(20,21)11-3-4-13(22-2)12(9-11)14(16)19;/h3-4,9,17-18H,5-8,10H2,1-2H3,(H2,16,19);1H
InChIKeyOBCQDZGRPMARPP-UHFFFAOYSA-N
MW377.89 g/mol
LogP0.88
Rot. Bonds6

About 2-methoxy-5-[(4-methylpiperidin-4-yl)methylsulfamoyl]benzamide;hydrochloride

2-methoxy-5-[(4-methylpiperidin-4-yl)methylsulfamoyl]benzamide;hydrochloride (PubChem CID 120720413) has the molecular formula C15H24ClN3O4S and a molecular weight of 377.89 g/mol. Its IUPAC name is 2-methoxy-5-[(4-methylpiperidin-4-yl)methylsulfamoyl]benzamide;hydrochloride.

Molecular Properties

Compound Name2-methoxy-5-[(4-methylpiperidin-4-yl)methylsulfamoyl]benzamide;hydrochloride
PubChem CID120720413
Molecular FormulaC15H24ClN3O4S
Molecular Weight377.89 g/mol
Exact Mass377.12
IUPAC Name2-methoxy-5-[(4-methylpiperidin-4-yl)methylsulfamoyl]benzamide;hydrochloride
SMILESCOc1ccc(S(=O)(=O)NCC2(C)CCNCC2)cc1C(N)=O.Cl
InChIInChI=1S/C15H23N3O4S.ClH/c1-15(5-7-17-8-6-15)10-18-23(20,21)11-3-4-13(22-2)12(9-11)14(16)19;/h3-4,9,17-18H,5-8,10H2,1-2H3,(H2,16,19);1H
InChIKeyOBCQDZGRPMARPP-UHFFFAOYSA-N
XLogP0.88
TPSA110.52 Ų
H-Bond Donors3
H-Bond Acceptors5
Rotatable Bonds6
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500377.89
LogP ≤ 50.88
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 105

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Related Compounds

5-[(1-aminocyclohexyl)methylsulfamoyl]-2-methoxybenzamide
CID 119958906
5-[(3,3-dimethylpiperidin-2-yl)methylsulfamoyl]-2-methoxybenzamide;hydrochloride
CID 120666289
2-methoxy-5-(pyrrolidin-3-ylmethylsulfamoyl)benzamide;hydrochloride
CID 120721043
2-methoxy-5-(pyrrolidin-2-ylmethylsulfamoyl)benzamide;hydrochloride
CID 119974021
5-[[1-(dimethylamino)-4-methylcyclohexyl]methylsulfamoyl]-2-methoxybenzamide
CID 146022773
2-methoxy-5-[[1-(4-methylpiperazin-1-yl)cyclohexyl]methylsulfamoyl]benzamide
CID 146024591
5-[(2-hydroxy-2-methylpropyl)sulfamoyl]-2-methoxybenzamide
CID 65113342
3,4-dimethoxy-N-[[4-(methoxymethyl)piperidin-4-yl]methyl]benzenesulfonamide
CID 120896903
3-bromo-4-methoxy-N-[(1-methylcyclopropyl)methyl]benzenesulfonamide
CID 103723853
5-[(3-hydroxycyclobutyl)methylsulfamoyl]-2-methoxybenzamide
CID 66006744
4-(4-methoxyphenoxy)-N-[(4-methylpiperidin-4-yl)methyl]benzenesulfonamide
CID 120720556
3-chloro-4-(difluoromethoxy)-N-[(4-methylpiperidin-4-yl)methyl]benzenesulfonamide;hydrochloride
CID 120720121

Frequently Asked Questions

What is the IUPAC name of 2-methoxy-5-[(4-methylpiperidin-4-yl)methylsulfamoyl]benzamide;hydrochloride?
The IUPAC name of 2-methoxy-5-[(4-methylpiperidin-4-yl)methylsulfamoyl]benzamide;hydrochloride (CID 120720413) is 2-methoxy-5-[(4-methylpiperidin-4-yl)methylsulfamoyl]benzamide;hydrochloride.
What is the SMILES notation for 2-methoxy-5-[(4-methylpiperidin-4-yl)methylsulfamoyl]benzamide;hydrochloride?
The canonical SMILES for 2-methoxy-5-[(4-methylpiperidin-4-yl)methylsulfamoyl]benzamide;hydrochloride is COc1ccc(S(=O)(=O)NCC2(C)CCNCC2)cc1C(N)=O.Cl.
What is the InChIKey of 2-methoxy-5-[(4-methylpiperidin-4-yl)methylsulfamoyl]benzamide;hydrochloride?
The InChIKey is OBCQDZGRPMARPP-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H23N3O4S.ClH/c1-15(5-7-17-8-6-15)10-18-23(20,21)11-3-4-13(22-2)12(9-11)14(16)19;/h3-4,9,17-18H,5-8,10H2,1-2H3,(H2,16,19);1H.
What are the key properties of 2-methoxy-5-[(4-methylpiperidin-4-yl)methylsulfamoyl]benzamide;hydrochloride?
2-methoxy-5-[(4-methylpiperidin-4-yl)methylsulfamoyl]benzamide;hydrochloride has a molecular weight of 377.89 g/mol, XLogP of 0.88, 6 rotatable bonds, 3 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 2-methoxy-5-[(4-methylpiperidin-4-yl)methylsulfamoyl]benzamide;hydrochloride is sourced from PubChem (CID 120720413), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).