3-amino-N-[2-(2-methylphenyl)ethyl]pyridine-2-sulfonamide

C14H17N3O2S — CID 103306499

IUPAC3-amino-N-[2-(2-methylphenyl)ethyl]pyridine-2-sulfonamide
SMILESCc1ccccc1CCNS(=O)(=O)c1ncccc1N
InChIInChI=1S/C14H17N3O2S/c1-11-5-2-3-6-12(11)8-10-17-20(18,19)14-13(15)7-4-9-16-14/h2-7,9,17H,8,10,15H2,1H3
InChIKeyRLJQNRQMEDWSEB-UHFFFAOYSA-N
MW291.38 g/mol
LogP1.49
Rot. Bonds5

About 3-amino-N-[2-(2-methylphenyl)ethyl]pyridine-2-sulfonamide

3-amino-N-[2-(2-methylphenyl)ethyl]pyridine-2-sulfonamide (PubChem CID 103306499) has the molecular formula C14H17N3O2S and a molecular weight of 291.38 g/mol. Its IUPAC name is 3-amino-N-[2-(2-methylphenyl)ethyl]pyridine-2-sulfonamide.

Molecular Properties

Compound Name3-amino-N-[2-(2-methylphenyl)ethyl]pyridine-2-sulfonamide
PubChem CID103306499
Molecular FormulaC14H17N3O2S
Molecular Weight291.38 g/mol
Exact Mass291.10
IUPAC Name3-amino-N-[2-(2-methylphenyl)ethyl]pyridine-2-sulfonamide
SMILESCc1ccccc1CCNS(=O)(=O)c1ncccc1N
InChIInChI=1S/C14H17N3O2S/c1-11-5-2-3-6-12(11)8-10-17-20(18,19)14-13(15)7-4-9-16-14/h2-7,9,17H,8,10,15H2,1H3
InChIKeyRLJQNRQMEDWSEB-UHFFFAOYSA-N
XLogP1.49
TPSA85.08 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500291.38
LogP ≤ 51.49
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Related Compounds

2-amino-N-[2-(2-methylphenyl)ethyl]benzenesulfonamide
CID 22722440
3-amino-N-(2-methoxyethyl)pyridine-2-sulfonamide
CID 103303676
3-amino-N-decylpyridine-2-sulfonamide
CID 103306537
2-amino-6-chloro-N-[2-(2-methylphenyl)ethyl]benzenesulfonamide
CID 79756335
3-amino-N-[2-(ethylsulfamoyl)ethyl]pyridine-2-sulfonamide
CID 106342302
3-amino-N-(4-methoxybutyl)pyridine-2-sulfonamide
CID 103305180
3-amino-N-(3-methyl-2-pyridinyl)pyridine-2-sulfonamide
CID 103303464
5-amino-2-methyl-N-[2-(2-methylphenyl)ethyl]benzenesulfonamide
CID 78984276
2-chloro-N-[2-(2-methylphenyl)ethyl]pyrimidine-5-sulfonamide
CID 79763049
3-amino-N-[(4-fluoro-3,5-dimethylphenyl)methyl]pyridine-2-sulfonamide
CID 103306559
2-methyl-N-[2-(2-methylphenyl)ethyl]-1H-imidazole-5-sulfonamide
CID 79755225
3-amino-N-[2-(3-methylbutoxy)ethyl]pyridine-2-sulfonamide
CID 103305551

Frequently Asked Questions

What is the IUPAC name of 3-amino-N-[2-(2-methylphenyl)ethyl]pyridine-2-sulfonamide?
The IUPAC name of 3-amino-N-[2-(2-methylphenyl)ethyl]pyridine-2-sulfonamide (CID 103306499) is 3-amino-N-[2-(2-methylphenyl)ethyl]pyridine-2-sulfonamide.
What is the SMILES notation for 3-amino-N-[2-(2-methylphenyl)ethyl]pyridine-2-sulfonamide?
The canonical SMILES for 3-amino-N-[2-(2-methylphenyl)ethyl]pyridine-2-sulfonamide is Cc1ccccc1CCNS(=O)(=O)c1ncccc1N.
What is the InChIKey of 3-amino-N-[2-(2-methylphenyl)ethyl]pyridine-2-sulfonamide?
The InChIKey is RLJQNRQMEDWSEB-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H17N3O2S/c1-11-5-2-3-6-12(11)8-10-17-20(18,19)14-13(15)7-4-9-16-14/h2-7,9,17H,8,10,15H2,1H3.
What are the key properties of 3-amino-N-[2-(2-methylphenyl)ethyl]pyridine-2-sulfonamide?
3-amino-N-[2-(2-methylphenyl)ethyl]pyridine-2-sulfonamide has a molecular weight of 291.38 g/mol, XLogP of 1.49, 5 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 3-amino-N-[2-(2-methylphenyl)ethyl]pyridine-2-sulfonamide is sourced from PubChem (CID 103306499), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).