2-amino-N-[(1R)-2-hydroxy-1-phenylethyl]pyridine-3-sulfonamide

C13H15N3O3S — CID 107862017

IUPAC2-amino-N-[(1R)-2-hydroxy-1-phenylethyl]pyridine-3-sulfonamide
SMILESNc1ncccc1S(=O)(=O)N[C@@H](CO)c1ccccc1
InChIInChI=1S/C13H15N3O3S/c14-13-12(7-4-8-15-13)20(18,19)16-11(9-17)10-5-2-1-3-6-10/h1-8,11,16-17H,9H2,(H2,14,15)/t11-/m0/s1
InChIKeyMWYAXXMZHQABAU-NSHDSACASA-N
MW293.35 g/mol
LogP0.68
Rot. Bonds5

About 2-amino-N-[(1R)-2-hydroxy-1-phenylethyl]pyridine-3-sulfonamide

2-amino-N-[(1R)-2-hydroxy-1-phenylethyl]pyridine-3-sulfonamide (PubChem CID 107862017) has the molecular formula C13H15N3O3S and a molecular weight of 293.35 g/mol. Its IUPAC name is 2-amino-N-[(1R)-2-hydroxy-1-phenylethyl]pyridine-3-sulfonamide.

Molecular Properties

Compound Name2-amino-N-[(1R)-2-hydroxy-1-phenylethyl]pyridine-3-sulfonamide
PubChem CID107862017
Molecular FormulaC13H15N3O3S
Molecular Weight293.35 g/mol
Exact Mass293.08
IUPAC Name2-amino-N-[(1R)-2-hydroxy-1-phenylethyl]pyridine-3-sulfonamide
SMILESNc1ncccc1S(=O)(=O)N[C@@H](CO)c1ccccc1
InChIInChI=1S/C13H15N3O3S/c14-13-12(7-4-8-15-13)20(18,19)16-11(9-17)10-5-2-1-3-6-10/h1-8,11,16-17H,9H2,(H2,14,15)/t11-/m0/s1
InChIKeyMWYAXXMZHQABAU-NSHDSACASA-N
XLogP0.68
TPSA105.31 Ų
H-Bond Donors3
H-Bond Acceptors5
Rotatable Bonds5
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500293.35
LogP ≤ 50.68
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 105

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Related Compounds

2-amino-N-(2-hydroxy-1-phenylethyl)benzenesulfonamide
CID 63182594
2-amino-N-(1-hydroxypropan-2-yl)pyridine-3-sulfonamide
CID 65427987
2-amino-N-[(2S)-1-hydroxypropan-2-yl]pyridine-3-sulfonamide
CID 107212659
2-amino-N-[(1S)-1-phenylethyl]pyridine-3-sulfonamide
CID 107864042
2-amino-N-(1-hydroxybutan-2-yl)pyridine-3-sulfonamide
CID 65427796
5-amino-N-(2-hydroxy-1-phenylethyl)-1H-pyrazole-4-sulfonamide
CID 55160188
2,3-dichloro-N-[(1R)-2-hydroxy-1-phenylethyl]benzenesulfonamide
CID 103837084
methyl 2-[(2-hydroxy-1-phenylethyl)sulfamoyl]benzoate
CID 3447772
2-amino-N-pentan-3-ylpyridine-3-sulfonamide
CID 62149159
1-N,3-N-bis[(1S)-2-hydroxy-1-phenylethyl]benzene-1,3-disulfonamide
CID 101191621
2-amino-N-[(1S)-2-hydroxy-1-phenylethyl]-4-methylbenzenesulfonamide
CID 107861957
4-amino-2-chloro-N-[(1S)-2-hydroxy-1-phenylethyl]benzenesulfonamide
CID 107861980

Frequently Asked Questions

What is the IUPAC name of 2-amino-N-[(1R)-2-hydroxy-1-phenylethyl]pyridine-3-sulfonamide?
The IUPAC name of 2-amino-N-[(1R)-2-hydroxy-1-phenylethyl]pyridine-3-sulfonamide (CID 107862017) is 2-amino-N-[(1R)-2-hydroxy-1-phenylethyl]pyridine-3-sulfonamide.
What is the SMILES notation for 2-amino-N-[(1R)-2-hydroxy-1-phenylethyl]pyridine-3-sulfonamide?
The canonical SMILES for 2-amino-N-[(1R)-2-hydroxy-1-phenylethyl]pyridine-3-sulfonamide is Nc1ncccc1S(=O)(=O)N[C@@H](CO)c1ccccc1.
What is the InChIKey of 2-amino-N-[(1R)-2-hydroxy-1-phenylethyl]pyridine-3-sulfonamide?
The InChIKey is MWYAXXMZHQABAU-NSHDSACASA-N. The full InChI is InChI=1S/C13H15N3O3S/c14-13-12(7-4-8-15-13)20(18,19)16-11(9-17)10-5-2-1-3-6-10/h1-8,11,16-17H,9H2,(H2,14,15)/t11-/m0/s1.
What are the key properties of 2-amino-N-[(1R)-2-hydroxy-1-phenylethyl]pyridine-3-sulfonamide?
2-amino-N-[(1R)-2-hydroxy-1-phenylethyl]pyridine-3-sulfonamide has a molecular weight of 293.35 g/mol, XLogP of 0.68, 5 rotatable bonds, 3 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 2-amino-N-[(1R)-2-hydroxy-1-phenylethyl]pyridine-3-sulfonamide is sourced from PubChem (CID 107862017), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).