4-(phenylsulfamoyl)-N-(piperidin-3-ylmethyl)benzamide

C19H23N3O3S — CID 119461716

IUPAC4-(phenylsulfamoyl)-N-(piperidin-3-ylmethyl)benzamide
SMILESO=C(NCC1CCCNC1)c1ccc(S(=O)(=O)Nc2ccccc2)cc1
InChIInChI=1S/C19H23N3O3S/c23-19(21-14-15-5-4-12-20-13-15)16-8-10-18(11-9-16)26(24,25)22-17-6-2-1-3-7-17/h1-3,6-11,15,20,22H,4-5,12-14H2,(H,21,23)
InChIKeyJLQIJISTXYEPSZ-UHFFFAOYSA-N
MW373.48 g/mol
LogP2.22
Rot. Bonds6

About 4-(phenylsulfamoyl)-N-(piperidin-3-ylmethyl)benzamide

4-(phenylsulfamoyl)-N-(piperidin-3-ylmethyl)benzamide (PubChem CID 119461716) has the molecular formula C19H23N3O3S and a molecular weight of 373.48 g/mol. Its IUPAC name is 4-(phenylsulfamoyl)-N-(piperidin-3-ylmethyl)benzamide.

Molecular Properties

Compound Name4-(phenylsulfamoyl)-N-(piperidin-3-ylmethyl)benzamide
PubChem CID119461716
Molecular FormulaC19H23N3O3S
Molecular Weight373.48 g/mol
Exact Mass373.15
IUPAC Name4-(phenylsulfamoyl)-N-(piperidin-3-ylmethyl)benzamide
SMILESO=C(NCC1CCCNC1)c1ccc(S(=O)(=O)Nc2ccccc2)cc1
InChIInChI=1S/C19H23N3O3S/c23-19(21-14-15-5-4-12-20-13-15)16-8-10-18(11-9-16)26(24,25)22-17-6-2-1-3-7-17/h1-3,6-11,15,20,22H,4-5,12-14H2,(H,21,23)
InChIKeyJLQIJISTXYEPSZ-UHFFFAOYSA-N
XLogP2.22
TPSA87.30 Ų
H-Bond Donors3
H-Bond Acceptors4
Rotatable Bonds6
Heavy Atoms26
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500373.48
LogP ≤ 52.22
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 104

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Related Compounds

4-[(4-methylphenyl)sulfamoyl]-N-(piperidin-3-ylmethyl)benzamide
CID 119462922
4-benzylsulfonyl-N-(piperidin-3-ylmethyl)benzamide
CID 119462777
N-(piperidin-3-ylmethyl)benzamide;hydrochloride
CID 119461032
4-(phenylcarbamoylamino)-N-(piperidin-3-ylmethyl)benzamide;hydrochloride
CID 119462020
4-(difluoromethylsulfonyl)-N-(piperidin-3-ylmethyl)benzamide
CID 119461851
4-fluoro-N-(piperidin-3-ylmethyl)benzamide;hydrochloride
CID 119462898
N-[(1-phenylpyrrolidin-3-yl)methyl]-4-(phenylsulfamoyl)benzamide
CID 46403235
4-[2-(dimethylamino)-2-oxoethyl]sulfonyl-N-(piperidin-3-ylmethyl)benzamide;hydrochloride
CID 119463409
N-(piperidin-3-ylmethyl)-4-(trifluoromethyl)benzamide
CID 24701631
4-methylsulfonyl-N-(pyrrolidin-3-ylmethyl)benzamide
CID 80564844
4-(phenylsulfanylmethyl)-N-(piperidin-3-ylmethyl)benzamide;hydrochloride
CID 119464249
4-(dimethylamino)-N-(piperidin-3-ylmethyl)benzamide
CID 43329219

Frequently Asked Questions

What is the IUPAC name of 4-(phenylsulfamoyl)-N-(piperidin-3-ylmethyl)benzamide?
The IUPAC name of 4-(phenylsulfamoyl)-N-(piperidin-3-ylmethyl)benzamide (CID 119461716) is 4-(phenylsulfamoyl)-N-(piperidin-3-ylmethyl)benzamide.
What is the SMILES notation for 4-(phenylsulfamoyl)-N-(piperidin-3-ylmethyl)benzamide?
The canonical SMILES for 4-(phenylsulfamoyl)-N-(piperidin-3-ylmethyl)benzamide is O=C(NCC1CCCNC1)c1ccc(S(=O)(=O)Nc2ccccc2)cc1.
What is the InChIKey of 4-(phenylsulfamoyl)-N-(piperidin-3-ylmethyl)benzamide?
The InChIKey is JLQIJISTXYEPSZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H23N3O3S/c23-19(21-14-15-5-4-12-20-13-15)16-8-10-18(11-9-16)26(24,25)22-17-6-2-1-3-7-17/h1-3,6-11,15,20,22H,4-5,12-14H2,(H,21,23).
What are the key properties of 4-(phenylsulfamoyl)-N-(piperidin-3-ylmethyl)benzamide?
4-(phenylsulfamoyl)-N-(piperidin-3-ylmethyl)benzamide has a molecular weight of 373.48 g/mol, XLogP of 2.22, 6 rotatable bonds, 3 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 4-(phenylsulfamoyl)-N-(piperidin-3-ylmethyl)benzamide is sourced from PubChem (CID 119461716), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).