3-(piperidin-4-ylsulfamoyl)-N-(2-pyrazol-1-ylethyl)benzamide

C17H23N5O3S — CID 72877192

IUPAC3-(piperidin-4-ylsulfamoyl)-N-(2-pyrazol-1-ylethyl)benzamide
SMILESO=C(NCCn1cccn1)c1cccc(S(=O)(=O)NC2CCNCC2)c1
InChIInChI=1S/C17H23N5O3S/c23-17(19-10-12-22-11-2-7-20-22)14-3-1-4-16(13-14)26(24,25)21-15-5-8-18-9-6-15/h1-4,7,11,13,15,18,21H,5-6,8-10,12H2,(H,19,23)
InChIKeyGQCFKMCCUMXESL-UHFFFAOYSA-N
MW377.47 g/mol
LogP0.34
Rot. Bonds7

About 3-(piperidin-4-ylsulfamoyl)-N-(2-pyrazol-1-ylethyl)benzamide

3-(piperidin-4-ylsulfamoyl)-N-(2-pyrazol-1-ylethyl)benzamide (PubChem CID 72877192) has the molecular formula C17H23N5O3S and a molecular weight of 377.47 g/mol. Its IUPAC name is 3-(piperidin-4-ylsulfamoyl)-N-(2-pyrazol-1-ylethyl)benzamide.

Molecular Properties

Compound Name3-(piperidin-4-ylsulfamoyl)-N-(2-pyrazol-1-ylethyl)benzamide
PubChem CID72877192
Molecular FormulaC17H23N5O3S
Molecular Weight377.47 g/mol
Exact Mass377.15
IUPAC Name3-(piperidin-4-ylsulfamoyl)-N-(2-pyrazol-1-ylethyl)benzamide
SMILESO=C(NCCn1cccn1)c1cccc(S(=O)(=O)NC2CCNCC2)c1
InChIInChI=1S/C17H23N5O3S/c23-17(19-10-12-22-11-2-7-20-22)14-3-1-4-16(13-14)26(24,25)21-15-5-8-18-9-6-15/h1-4,7,11,13,15,18,21H,5-6,8-10,12H2,(H,19,23)
InChIKeyGQCFKMCCUMXESL-UHFFFAOYSA-N
XLogP0.34
TPSA105.12 Ų
H-Bond Donors3
H-Bond Acceptors6
Rotatable Bonds7
Heavy Atoms26
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500377.47
LogP ≤ 50.34
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 106

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Frequently Asked Questions

What is the IUPAC name of 3-(piperidin-4-ylsulfamoyl)-N-(2-pyrazol-1-ylethyl)benzamide?
The IUPAC name of 3-(piperidin-4-ylsulfamoyl)-N-(2-pyrazol-1-ylethyl)benzamide (CID 72877192) is 3-(piperidin-4-ylsulfamoyl)-N-(2-pyrazol-1-ylethyl)benzamide.
What is the SMILES notation for 3-(piperidin-4-ylsulfamoyl)-N-(2-pyrazol-1-ylethyl)benzamide?
The canonical SMILES for 3-(piperidin-4-ylsulfamoyl)-N-(2-pyrazol-1-ylethyl)benzamide is O=C(NCCn1cccn1)c1cccc(S(=O)(=O)NC2CCNCC2)c1.
What is the InChIKey of 3-(piperidin-4-ylsulfamoyl)-N-(2-pyrazol-1-ylethyl)benzamide?
The InChIKey is GQCFKMCCUMXESL-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H23N5O3S/c23-17(19-10-12-22-11-2-7-20-22)14-3-1-4-16(13-14)26(24,25)21-15-5-8-18-9-6-15/h1-4,7,11,13,15,18,21H,5-6,8-10,12H2,(H,19,23).
What are the key properties of 3-(piperidin-4-ylsulfamoyl)-N-(2-pyrazol-1-ylethyl)benzamide?
3-(piperidin-4-ylsulfamoyl)-N-(2-pyrazol-1-ylethyl)benzamide has a molecular weight of 377.47 g/mol, XLogP of 0.34, 7 rotatable bonds, 3 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 3-(piperidin-4-ylsulfamoyl)-N-(2-pyrazol-1-ylethyl)benzamide is sourced from PubChem (CID 72877192), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).