3-amino-N-(1-phenylethyl)pyridine-2-sulfonamide

C13H15N3O2S — CID 103303814

IUPAC3-amino-N-(1-phenylethyl)pyridine-2-sulfonamide
SMILESCC(NS(=O)(=O)c1ncccc1N)c1ccccc1
InChIInChI=1S/C13H15N3O2S/c1-10(11-6-3-2-4-7-11)16-19(17,18)13-12(14)8-5-9-15-13/h2-10,16H,14H2,1H3
InChIKeyRTDBKXKKSURSGC-UHFFFAOYSA-N
MW277.35 g/mol
LogP1.70
Rot. Bonds4

About 3-amino-N-(1-phenylethyl)pyridine-2-sulfonamide

3-amino-N-(1-phenylethyl)pyridine-2-sulfonamide (PubChem CID 103303814) has the molecular formula C13H15N3O2S and a molecular weight of 277.35 g/mol. Its IUPAC name is 3-amino-N-(1-phenylethyl)pyridine-2-sulfonamide.

Molecular Properties

Compound Name3-amino-N-(1-phenylethyl)pyridine-2-sulfonamide
PubChem CID103303814
Molecular FormulaC13H15N3O2S
Molecular Weight277.35 g/mol
Exact Mass277.09
IUPAC Name3-amino-N-(1-phenylethyl)pyridine-2-sulfonamide
SMILESCC(NS(=O)(=O)c1ncccc1N)c1ccccc1
InChIInChI=1S/C13H15N3O2S/c1-10(11-6-3-2-4-7-11)16-19(17,18)13-12(14)8-5-9-15-13/h2-10,16H,14H2,1H3
InChIKeyRTDBKXKKSURSGC-UHFFFAOYSA-N
XLogP1.70
TPSA85.08 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500277.35
LogP ≤ 51.70
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Related Compounds

3-amino-N-propan-2-ylpyridine-2-sulfonamide
CID 103303655
2-amino-N-[(1S)-1-phenylethyl]pyridine-3-sulfonamide
CID 107864042
3-amino-N-(4-methylpentan-2-yl)pyridine-2-sulfonamide
CID 103304535
3-amino-N-[1-(1H-1,2,4-triazol-5-yl)ethyl]pyridine-2-sulfonamide
CID 106283511
2-amino-N-(1-phenylethyl)benzenesulfonamide
CID 16788499
3-amino-N-[1-(2,4-dimethyl-1,3-thiazol-5-yl)ethyl]pyridine-2-sulfonamide
CID 103305354
3-amino-N-phenylpyridine-2-sulfonamide
CID 15358385
N-(1-phenylethyl)benzenesulfonamide;hydrochloride
CID 70281153
3-amino-N-(1-thiophen-3-ylpropan-2-yl)pyridine-2-sulfonamide
CID 103305478
N-(1-phenylethyl)-7H-pyrrolo[3,4-b]pyridine-5-sulfonamide
CID 162256037
6-amino-2,3-dimethyl-N-[(1S)-1-phenylethyl]benzenesulfonamide
CID 107864030
2-hydrazinyl-N-(1-phenylethyl)pyrimidine-5-sulfonamide
CID 61328714

Frequently Asked Questions

What is the IUPAC name of 3-amino-N-(1-phenylethyl)pyridine-2-sulfonamide?
The IUPAC name of 3-amino-N-(1-phenylethyl)pyridine-2-sulfonamide (CID 103303814) is 3-amino-N-(1-phenylethyl)pyridine-2-sulfonamide.
What is the SMILES notation for 3-amino-N-(1-phenylethyl)pyridine-2-sulfonamide?
The canonical SMILES for 3-amino-N-(1-phenylethyl)pyridine-2-sulfonamide is CC(NS(=O)(=O)c1ncccc1N)c1ccccc1.
What is the InChIKey of 3-amino-N-(1-phenylethyl)pyridine-2-sulfonamide?
The InChIKey is RTDBKXKKSURSGC-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H15N3O2S/c1-10(11-6-3-2-4-7-11)16-19(17,18)13-12(14)8-5-9-15-13/h2-10,16H,14H2,1H3.
What are the key properties of 3-amino-N-(1-phenylethyl)pyridine-2-sulfonamide?
3-amino-N-(1-phenylethyl)pyridine-2-sulfonamide has a molecular weight of 277.35 g/mol, XLogP of 1.70, 4 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 3-amino-N-(1-phenylethyl)pyridine-2-sulfonamide is sourced from PubChem (CID 103303814), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).