N-(4-piperidin-1-ylphenyl)-4-sulfamoylbenzamide

C18H21N3O3S — CID 26654878

IUPACN-(4-piperidin-1-ylphenyl)-4-sulfamoylbenzamide
SMILESNS(=O)(=O)c1ccc(C(=O)Nc2ccc(N3CCCCC3)cc2)cc1
InChIInChI=1S/C18H21N3O3S/c19-25(23,24)17-10-4-14(5-11-17)18(22)20-15-6-8-16(9-7-15)21-12-2-1-3-13-21/h4-11H,1-3,12-13H2,(H,20,22)(H2,19,23,24)
InChIKeyBLWJEYYYSGGXNP-UHFFFAOYSA-N
MW359.45 g/mol
LogP2.58
Rot. Bonds4

About N-(4-piperidin-1-ylphenyl)-4-sulfamoylbenzamide

N-(4-piperidin-1-ylphenyl)-4-sulfamoylbenzamide (PubChem CID 26654878) has the molecular formula C18H21N3O3S and a molecular weight of 359.45 g/mol. Its IUPAC name is N-(4-piperidin-1-ylphenyl)-4-sulfamoylbenzamide.

Molecular Properties

Compound NameN-(4-piperidin-1-ylphenyl)-4-sulfamoylbenzamide
PubChem CID26654878
Molecular FormulaC18H21N3O3S
Molecular Weight359.45 g/mol
Exact Mass359.13
IUPAC NameN-(4-piperidin-1-ylphenyl)-4-sulfamoylbenzamide
SMILESNS(=O)(=O)c1ccc(C(=O)Nc2ccc(N3CCCCC3)cc2)cc1
InChIInChI=1S/C18H21N3O3S/c19-25(23,24)17-10-4-14(5-11-17)18(22)20-15-6-8-16(9-7-15)21-12-2-1-3-13-21/h4-11H,1-3,12-13H2,(H,20,22)(H2,19,23,24)
InChIKeyBLWJEYYYSGGXNP-UHFFFAOYSA-N
XLogP2.58
TPSA92.50 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms25
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500359.45
LogP ≤ 52.58
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'anil_di_alk_A(478)', 'substructure': 'N/A'}

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Related Compounds

N-(6-piperidin-1-yl-3-pyridinyl)-4-sulfamoylbenzamide
CID 55502246
N-phenyl-4-piperidin-1-ylbenzamide
CID 53282261
N-(4-piperidin-1-ylphenyl)-4-(prop-2-enylsulfamoyl)benzamide
CID 17473471
4-tert-butyl-N-(4-piperidin-1-ylphenyl)benzamide
CID 682745
1-N-(4-methylphenyl)-4-N-(4-pyrrolidin-1-ylphenyl)benzene-1,4-dicarboxamide
CID 109049443
4-pyrrol-1-yl-N-(4-sulfamoylphenyl)benzamide
CID 26718752
4-benzoyl-N-(4-piperidin-1-ylphenyl)benzamide
CID 7999170
N-(4-ethylphenyl)-4-piperidin-1-ylbenzamide
CID 53282362
N-[4-(azepan-1-yl)phenyl]-4-(3-oxopiperazin-1-yl)sulfonylbenzamide
CID 55596636
4-acetamido-N-(4-sulfamoylphenyl)benzamide
CID 766030
1-N,4-N-bis[4-(azepan-1-ylsulfonyl)phenyl]benzene-1,4-dicarboxamide
CID 5167539
1-(4-piperidin-1-ylphenyl)-3-(3-sulfamoylphenyl)urea
CID 71896243

Frequently Asked Questions

What is the IUPAC name of N-(4-piperidin-1-ylphenyl)-4-sulfamoylbenzamide?
The IUPAC name of N-(4-piperidin-1-ylphenyl)-4-sulfamoylbenzamide (CID 26654878) is N-(4-piperidin-1-ylphenyl)-4-sulfamoylbenzamide.
What is the SMILES notation for N-(4-piperidin-1-ylphenyl)-4-sulfamoylbenzamide?
The canonical SMILES for N-(4-piperidin-1-ylphenyl)-4-sulfamoylbenzamide is NS(=O)(=O)c1ccc(C(=O)Nc2ccc(N3CCCCC3)cc2)cc1.
What is the InChIKey of N-(4-piperidin-1-ylphenyl)-4-sulfamoylbenzamide?
The InChIKey is BLWJEYYYSGGXNP-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H21N3O3S/c19-25(23,24)17-10-4-14(5-11-17)18(22)20-15-6-8-16(9-7-15)21-12-2-1-3-13-21/h4-11H,1-3,12-13H2,(H,20,22)(H2,19,23,24).
What are the key properties of N-(4-piperidin-1-ylphenyl)-4-sulfamoylbenzamide?
N-(4-piperidin-1-ylphenyl)-4-sulfamoylbenzamide has a molecular weight of 359.45 g/mol, XLogP of 2.58, 4 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-(4-piperidin-1-ylphenyl)-4-sulfamoylbenzamide is sourced from PubChem (CID 26654878), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).