N-(2-methoxyphenyl)-3-piperidin-1-ylsulfonylbenzamide

C19H22N2O4S — CID 1124158

IUPACN-(2-methoxyphenyl)-3-piperidin-1-ylsulfonylbenzamide
SMILESCOc1ccccc1NC(=O)c1cccc(S(=O)(=O)N2CCCCC2)c1
InChIInChI=1S/C19H22N2O4S/c1-25-18-11-4-3-10-17(18)20-19(22)15-8-7-9-16(14-15)26(23,24)21-12-5-2-6-13-21/h3-4,7-11,14H,2,5-6,12-13H2,1H3,(H,20,22)
InChIKeyAWLTZAQBCIRMSH-UHFFFAOYSA-N
MW374.46 g/mol
LogP3.12
Rot. Bonds5

About N-(2-methoxyphenyl)-3-piperidin-1-ylsulfonylbenzamide

N-(2-methoxyphenyl)-3-piperidin-1-ylsulfonylbenzamide (PubChem CID 1124158) has the molecular formula C19H22N2O4S and a molecular weight of 374.46 g/mol. Its IUPAC name is N-(2-methoxyphenyl)-3-piperidin-1-ylsulfonylbenzamide.

Molecular Properties

Compound NameN-(2-methoxyphenyl)-3-piperidin-1-ylsulfonylbenzamide
PubChem CID1124158
Molecular FormulaC19H22N2O4S
Molecular Weight374.46 g/mol
Exact Mass374.13
IUPAC NameN-(2-methoxyphenyl)-3-piperidin-1-ylsulfonylbenzamide
SMILESCOc1ccccc1NC(=O)c1cccc(S(=O)(=O)N2CCCCC2)c1
InChIInChI=1S/C19H22N2O4S/c1-25-18-11-4-3-10-17(18)20-19(22)15-8-7-9-16(14-15)26(23,24)21-12-5-2-6-13-21/h3-4,7-11,14H,2,5-6,12-13H2,1H3,(H,20,22)
InChIKeyAWLTZAQBCIRMSH-UHFFFAOYSA-N
XLogP3.12
TPSA75.71 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms26
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500374.46
LogP ≤ 53.12
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

Analyze N-(2-methoxyphenyl)-3-piperidin-1-ylsulfonylbenzamide with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Frequently Asked Questions

What is the IUPAC name of N-(2-methoxyphenyl)-3-piperidin-1-ylsulfonylbenzamide?
The IUPAC name of N-(2-methoxyphenyl)-3-piperidin-1-ylsulfonylbenzamide (CID 1124158) is N-(2-methoxyphenyl)-3-piperidin-1-ylsulfonylbenzamide.
What is the SMILES notation for N-(2-methoxyphenyl)-3-piperidin-1-ylsulfonylbenzamide?
The canonical SMILES for N-(2-methoxyphenyl)-3-piperidin-1-ylsulfonylbenzamide is COc1ccccc1NC(=O)c1cccc(S(=O)(=O)N2CCCCC2)c1.
What is the InChIKey of N-(2-methoxyphenyl)-3-piperidin-1-ylsulfonylbenzamide?
The InChIKey is AWLTZAQBCIRMSH-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H22N2O4S/c1-25-18-11-4-3-10-17(18)20-19(22)15-8-7-9-16(14-15)26(23,24)21-12-5-2-6-13-21/h3-4,7-11,14H,2,5-6,12-13H2,1H3,(H,20,22).
What are the key properties of N-(2-methoxyphenyl)-3-piperidin-1-ylsulfonylbenzamide?
N-(2-methoxyphenyl)-3-piperidin-1-ylsulfonylbenzamide has a molecular weight of 374.46 g/mol, XLogP of 3.12, 5 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2-methoxyphenyl)-3-piperidin-1-ylsulfonylbenzamide is sourced from PubChem (CID 1124158), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).