3-amino-N-[4-(2-hydroxyethyl)phenyl]pyridine-2-sulfonamide

C13H15N3O3S — CID 103304997

IUPAC3-amino-N-[4-(2-hydroxyethyl)phenyl]pyridine-2-sulfonamide
SMILESNc1cccnc1S(=O)(=O)Nc1ccc(CCO)cc1
InChIInChI=1S/C13H15N3O3S/c14-12-2-1-8-15-13(12)20(18,19)16-11-5-3-10(4-6-11)7-9-17/h1-6,8,16-17H,7,9,14H2
InChIKeyKTSWNUCUCRLYOL-UHFFFAOYSA-N
MW293.35 g/mol
LogP1.00
Rot. Bonds5

About 3-amino-N-[4-(2-hydroxyethyl)phenyl]pyridine-2-sulfonamide

3-amino-N-[4-(2-hydroxyethyl)phenyl]pyridine-2-sulfonamide (PubChem CID 103304997) has the molecular formula C13H15N3O3S and a molecular weight of 293.35 g/mol. Its IUPAC name is 3-amino-N-[4-(2-hydroxyethyl)phenyl]pyridine-2-sulfonamide.

Molecular Properties

Compound Name3-amino-N-[4-(2-hydroxyethyl)phenyl]pyridine-2-sulfonamide
PubChem CID103304997
Molecular FormulaC13H15N3O3S
Molecular Weight293.35 g/mol
Exact Mass293.08
IUPAC Name3-amino-N-[4-(2-hydroxyethyl)phenyl]pyridine-2-sulfonamide
SMILESNc1cccnc1S(=O)(=O)Nc1ccc(CCO)cc1
InChIInChI=1S/C13H15N3O3S/c14-12-2-1-8-15-13(12)20(18,19)16-11-5-3-10(4-6-11)7-9-17/h1-6,8,16-17H,7,9,14H2
InChIKeyKTSWNUCUCRLYOL-UHFFFAOYSA-N
XLogP1.00
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 ≤ 51.00
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 105

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Frequently Asked Questions

What is the IUPAC name of 3-amino-N-[4-(2-hydroxyethyl)phenyl]pyridine-2-sulfonamide?
The IUPAC name of 3-amino-N-[4-(2-hydroxyethyl)phenyl]pyridine-2-sulfonamide (CID 103304997) is 3-amino-N-[4-(2-hydroxyethyl)phenyl]pyridine-2-sulfonamide.
What is the SMILES notation for 3-amino-N-[4-(2-hydroxyethyl)phenyl]pyridine-2-sulfonamide?
The canonical SMILES for 3-amino-N-[4-(2-hydroxyethyl)phenyl]pyridine-2-sulfonamide is Nc1cccnc1S(=O)(=O)Nc1ccc(CCO)cc1.
What is the InChIKey of 3-amino-N-[4-(2-hydroxyethyl)phenyl]pyridine-2-sulfonamide?
The InChIKey is KTSWNUCUCRLYOL-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H15N3O3S/c14-12-2-1-8-15-13(12)20(18,19)16-11-5-3-10(4-6-11)7-9-17/h1-6,8,16-17H,7,9,14H2.
What are the key properties of 3-amino-N-[4-(2-hydroxyethyl)phenyl]pyridine-2-sulfonamide?
3-amino-N-[4-(2-hydroxyethyl)phenyl]pyridine-2-sulfonamide has a molecular weight of 293.35 g/mol, XLogP of 1.00, 5 rotatable bonds, 3 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 3-amino-N-[4-(2-hydroxyethyl)phenyl]pyridine-2-sulfonamide is sourced from PubChem (CID 103304997), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).