N,3,4-trimethyl-N-piperidin-4-yl-5-sulfamoylbenzamide

C15H23N3O3S — CID 119443970

IUPACN,3,4-trimethyl-N-piperidin-4-yl-5-sulfamoylbenzamide
SMILESCc1cc(C(=O)N(C)C2CCNCC2)cc(S(N)(=O)=O)c1C
InChIInChI=1S/C15H23N3O3S/c1-10-8-12(9-14(11(10)2)22(16,20)21)15(19)18(3)13-4-6-17-7-5-13/h8-9,13,17H,4-7H2,1-3H3,(H2,16,20,21)
InChIKeyBLWBISVDVVTRHM-UHFFFAOYSA-N
MW325.43 g/mol
LogP0.77
Rot. Bonds3

About N,3,4-trimethyl-N-piperidin-4-yl-5-sulfamoylbenzamide

N,3,4-trimethyl-N-piperidin-4-yl-5-sulfamoylbenzamide (PubChem CID 119443970) has the molecular formula C15H23N3O3S and a molecular weight of 325.43 g/mol. Its IUPAC name is N,3,4-trimethyl-N-piperidin-4-yl-5-sulfamoylbenzamide.

Molecular Properties

Compound NameN,3,4-trimethyl-N-piperidin-4-yl-5-sulfamoylbenzamide
PubChem CID119443970
Molecular FormulaC15H23N3O3S
Molecular Weight325.43 g/mol
Exact Mass325.15
IUPAC NameN,3,4-trimethyl-N-piperidin-4-yl-5-sulfamoylbenzamide
SMILESCc1cc(C(=O)N(C)C2CCNCC2)cc(S(N)(=O)=O)c1C
InChIInChI=1S/C15H23N3O3S/c1-10-8-12(9-14(11(10)2)22(16,20)21)15(19)18(3)13-4-6-17-7-5-13/h8-9,13,17H,4-7H2,1-3H3,(H2,16,20,21)
InChIKeyBLWBISVDVVTRHM-UHFFFAOYSA-N
XLogP0.77
TPSA92.50 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500325.43
LogP ≤ 50.77
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Related Compounds

N,4-dimethyl-N-pyrrolidin-3-yl-3-sulfamoylbenzamide;hydrochloride
CID 154750787
N,3,5-trimethyl-N-piperidin-4-ylbenzamide
CID 43602069
N,4-dimethyl-3-methylsulfonyl-N-[(3S)-pyrrolidin-3-yl]benzamide
CID 124613574
3,5-dibromo-N-methyl-N-piperidin-4-ylbenzamide
CID 114022754
4-(difluoromethoxy)-N,3,5-trimethyl-N-piperidin-4-ylbenzamide;hydrochloride
CID 119444129
3-(cyclopentylsulfamoyl)-N,4-dimethyl-N-piperidin-4-ylbenzamide
CID 119442848
4-bromo-3-chloro-N-cyclopropyl-N-methyl-5-sulfamoylbenzamide
CID 81290579
N-methyl-N-piperidin-4-yl-3,5-bis(trifluoromethyl)benzamide
CID 119442576
N-(azepan-4-yl)-3,4-dihydroxy-N-methylbenzamide
CID 107728861
N,3,5-trimethyl-N-pyrrolidin-3-ylbenzamide;hydrochloride
CID 119551819
N,3,4-trimethyl-N-pyrrolidin-3-ylbenzamide;hydrochloride
CID 119554368
2,4-dichloro-N-methyl-5-methylsulfonyl-N-piperidin-4-ylbenzamide
CID 154759790

Frequently Asked Questions

What is the IUPAC name of N,3,4-trimethyl-N-piperidin-4-yl-5-sulfamoylbenzamide?
The IUPAC name of N,3,4-trimethyl-N-piperidin-4-yl-5-sulfamoylbenzamide (CID 119443970) is N,3,4-trimethyl-N-piperidin-4-yl-5-sulfamoylbenzamide.
What is the SMILES notation for N,3,4-trimethyl-N-piperidin-4-yl-5-sulfamoylbenzamide?
The canonical SMILES for N,3,4-trimethyl-N-piperidin-4-yl-5-sulfamoylbenzamide is Cc1cc(C(=O)N(C)C2CCNCC2)cc(S(N)(=O)=O)c1C.
What is the InChIKey of N,3,4-trimethyl-N-piperidin-4-yl-5-sulfamoylbenzamide?
The InChIKey is BLWBISVDVVTRHM-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H23N3O3S/c1-10-8-12(9-14(11(10)2)22(16,20)21)15(19)18(3)13-4-6-17-7-5-13/h8-9,13,17H,4-7H2,1-3H3,(H2,16,20,21).
What are the key properties of N,3,4-trimethyl-N-piperidin-4-yl-5-sulfamoylbenzamide?
N,3,4-trimethyl-N-piperidin-4-yl-5-sulfamoylbenzamide has a molecular weight of 325.43 g/mol, XLogP of 0.77, 3 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N,3,4-trimethyl-N-piperidin-4-yl-5-sulfamoylbenzamide is sourced from PubChem (CID 119443970), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).