N-(6-amino-3-pyridinyl)-2-phenylethanesulfonamide

C13H15N3O2S — CID 60792395

IUPACN-(6-amino-3-pyridinyl)-2-phenylethanesulfonamide
SMILESNc1ccc(NS(=O)(=O)CCc2ccccc2)cn1
InChIInChI=1S/C13H15N3O2S/c14-13-7-6-12(10-15-13)16-19(17,18)9-8-11-4-2-1-3-5-11/h1-7,10,16H,8-9H2,(H2,14,15)
InChIKeyNYQSXJGCLLTZKX-UHFFFAOYSA-N
MW277.35 g/mol
LogP1.65
Rot. Bonds5

About N-(6-amino-3-pyridinyl)-2-phenylethanesulfonamide

N-(6-amino-3-pyridinyl)-2-phenylethanesulfonamide (PubChem CID 60792395) has the molecular formula C13H15N3O2S and a molecular weight of 277.35 g/mol. Its IUPAC name is N-(6-amino-3-pyridinyl)-2-phenylethanesulfonamide.

Molecular Properties

Compound NameN-(6-amino-3-pyridinyl)-2-phenylethanesulfonamide
PubChem CID60792395
Molecular FormulaC13H15N3O2S
Molecular Weight277.35 g/mol
Exact Mass277.09
IUPAC NameN-(6-amino-3-pyridinyl)-2-phenylethanesulfonamide
SMILESNc1ccc(NS(=O)(=O)CCc2ccccc2)cn1
InChIInChI=1S/C13H15N3O2S/c14-13-7-6-12(10-15-13)16-19(17,18)9-8-11-4-2-1-3-5-11/h1-7,10,16H,8-9H2,(H2,14,15)
InChIKeyNYQSXJGCLLTZKX-UHFFFAOYSA-N
XLogP1.65
TPSA85.08 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500277.35
LogP ≤ 51.65
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Related Compounds

N-(6-amino-3-pyridinyl)-2-pyridin-2-ylethanesulfonamide
CID 55026068
2-phenyl-N-(6-propan-2-yloxy-3-pyridinyl)ethanesulfonamide
CID 71939376
N-[6-(N-methylanilino)-3-pyridinyl]-2-phenylethanesulfonamide
CID 113016544
N-[6-(butylamino)-3-pyridinyl]-2-phenylethanesulfonamide
CID 113009555
N-[6-(2-chloroanilino)-3-pyridinyl]-2-phenylethanesulfonamide
CID 113018483
N-[6-[2-(dimethylamino)ethylamino]-3-pyridinyl]-2-phenylethanesulfonamide
CID 113010814
N-[6-[(4-methylphenyl)methylamino]-3-pyridinyl]-2-phenylethanesulfonamide
CID 113011837
N-(3-amino-4-methylphenyl)-2-phenylethanesulfonamide
CID 39395711
N-[6-(3-chloroanilino)-3-pyridinyl]-2-phenylethanesulfonamide
CID 113018574
N-[4-[(4-fluorophenyl)methylamino]phenyl]-2-phenylethanesulfonamide
CID 112982516
N-(6-amino-3-pyridinyl)prop-2-ene-1-sulfonamide
CID 79673500
N-[4-(4-chloroanilino)phenyl]-2-phenylethanesulfonamide
CID 112987053

Frequently Asked Questions

What is the IUPAC name of N-(6-amino-3-pyridinyl)-2-phenylethanesulfonamide?
The IUPAC name of N-(6-amino-3-pyridinyl)-2-phenylethanesulfonamide (CID 60792395) is N-(6-amino-3-pyridinyl)-2-phenylethanesulfonamide.
What is the SMILES notation for N-(6-amino-3-pyridinyl)-2-phenylethanesulfonamide?
The canonical SMILES for N-(6-amino-3-pyridinyl)-2-phenylethanesulfonamide is Nc1ccc(NS(=O)(=O)CCc2ccccc2)cn1.
What is the InChIKey of N-(6-amino-3-pyridinyl)-2-phenylethanesulfonamide?
The InChIKey is NYQSXJGCLLTZKX-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H15N3O2S/c14-13-7-6-12(10-15-13)16-19(17,18)9-8-11-4-2-1-3-5-11/h1-7,10,16H,8-9H2,(H2,14,15).
What are the key properties of N-(6-amino-3-pyridinyl)-2-phenylethanesulfonamide?
N-(6-amino-3-pyridinyl)-2-phenylethanesulfonamide has a molecular weight of 277.35 g/mol, XLogP of 1.65, 5 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-(6-amino-3-pyridinyl)-2-phenylethanesulfonamide is sourced from PubChem (CID 60792395), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).