2-methyl-5-piperidin-1-ylsulfonyl-N-(1,2,4-triazol-4-yl)benzamide

C15H19N5O3S — CID 2344795

IUPAC2-methyl-5-piperidin-1-ylsulfonyl-N-(1,2,4-triazol-4-yl)benzamide
SMILESCc1ccc(S(=O)(=O)N2CCCCC2)cc1C(=O)Nn1cnnc1
InChIInChI=1S/C15H19N5O3S/c1-12-5-6-13(24(22,23)20-7-3-2-4-8-20)9-14(12)15(21)18-19-10-16-17-11-19/h5-6,9-11H,2-4,7-8H2,1H3,(H,18,21)
InChIKeyXXFXOPBJAQAXCI-UHFFFAOYSA-N
MW349.42 g/mol
LogP1.15
Rot. Bonds4

About 2-methyl-5-piperidin-1-ylsulfonyl-N-(1,2,4-triazol-4-yl)benzamide

2-methyl-5-piperidin-1-ylsulfonyl-N-(1,2,4-triazol-4-yl)benzamide (PubChem CID 2344795) has the molecular formula C15H19N5O3S and a molecular weight of 349.42 g/mol. Its IUPAC name is 2-methyl-5-piperidin-1-ylsulfonyl-N-(1,2,4-triazol-4-yl)benzamide.

Molecular Properties

Compound Name2-methyl-5-piperidin-1-ylsulfonyl-N-(1,2,4-triazol-4-yl)benzamide
PubChem CID2344795
Molecular FormulaC15H19N5O3S
Molecular Weight349.42 g/mol
Exact Mass349.12
IUPAC Name2-methyl-5-piperidin-1-ylsulfonyl-N-(1,2,4-triazol-4-yl)benzamide
SMILESCc1ccc(S(=O)(=O)N2CCCCC2)cc1C(=O)Nn1cnnc1
InChIInChI=1S/C15H19N5O3S/c1-12-5-6-13(24(22,23)20-7-3-2-4-8-20)9-14(12)15(21)18-19-10-16-17-11-19/h5-6,9-11H,2-4,7-8H2,1H3,(H,18,21)
InChIKeyXXFXOPBJAQAXCI-UHFFFAOYSA-N
XLogP1.15
TPSA97.19 Ų
H-Bond Donors1
H-Bond Acceptors6
Rotatable Bonds4
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500349.42
LogP ≤ 51.15
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 106

Analyze 2-methyl-5-piperidin-1-ylsulfonyl-N-(1,2,4-triazol-4-yl)benzamide with MolForge

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

Launch Full Analysis

Related Compounds

2-methyl-N-(4-methylpiperazin-4-ium-1-yl)-5-piperidin-1-ylsulfonylbenzamide
CID 2336259
N-(3,5-dimethylphenyl)-2-methyl-5-piperidin-1-ylsulfonylbenzamide
CID 29176549
2-methyl-5-piperidin-1-ylsulfonyl-N-prop-2-ynylbenzamide
CID 7997753
2-methyl-5-piperidin-1-ylsulfonylbenzoyl chloride
CID 20982783
N-(3,5-dimethylphenyl)-2-methyl-5-pyrrolidin-1-ylsulfonylbenzamide
CID 26696294
5-(azepan-1-ylsulfonyl)-N-butyl-2-methylbenzamide
CID 53281850
5-(azepan-1-ylsulfonyl)-2-methyl-N-(2-methylphenyl)benzamide
CID 53281813
azepan-1-yl-(2-methyl-5-piperidin-1-ylsulfonylphenyl)methanone
CID 2344798
5-(azepan-1-ylsulfonyl)-N-(2,4-dimethylphenyl)-2-methylbenzamide
CID 53281830
N-(4-iodophenyl)-2-methyl-5-piperidin-1-ylsulfonylbenzamide
CID 26638354
N-(3,5-difluorophenyl)-2-methyl-5-piperidin-1-ylsulfonylbenzamide
CID 27906905
N-(5-amino-2-methylphenyl)-2-methyl-5-piperidin-1-ylsulfonylbenzamide;hydrochloride
CID 120568671

Frequently Asked Questions

What is the IUPAC name of 2-methyl-5-piperidin-1-ylsulfonyl-N-(1,2,4-triazol-4-yl)benzamide?
The IUPAC name of 2-methyl-5-piperidin-1-ylsulfonyl-N-(1,2,4-triazol-4-yl)benzamide (CID 2344795) is 2-methyl-5-piperidin-1-ylsulfonyl-N-(1,2,4-triazol-4-yl)benzamide.
What is the SMILES notation for 2-methyl-5-piperidin-1-ylsulfonyl-N-(1,2,4-triazol-4-yl)benzamide?
The canonical SMILES for 2-methyl-5-piperidin-1-ylsulfonyl-N-(1,2,4-triazol-4-yl)benzamide is Cc1ccc(S(=O)(=O)N2CCCCC2)cc1C(=O)Nn1cnnc1.
What is the InChIKey of 2-methyl-5-piperidin-1-ylsulfonyl-N-(1,2,4-triazol-4-yl)benzamide?
The InChIKey is XXFXOPBJAQAXCI-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H19N5O3S/c1-12-5-6-13(24(22,23)20-7-3-2-4-8-20)9-14(12)15(21)18-19-10-16-17-11-19/h5-6,9-11H,2-4,7-8H2,1H3,(H,18,21).
What are the key properties of 2-methyl-5-piperidin-1-ylsulfonyl-N-(1,2,4-triazol-4-yl)benzamide?
2-methyl-5-piperidin-1-ylsulfonyl-N-(1,2,4-triazol-4-yl)benzamide has a molecular weight of 349.42 g/mol, XLogP of 1.15, 4 rotatable bonds, 1 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 2-methyl-5-piperidin-1-ylsulfonyl-N-(1,2,4-triazol-4-yl)benzamide is sourced from PubChem (CID 2344795), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).