N-(2-hydroxyethyl)-N-methyl-2-(methylamino)pyridine-4-sulfonamide

C9H15N3O3S — CID 62146541

IUPACN-(2-hydroxyethyl)-N-methyl-2-(methylamino)pyridine-4-sulfonamide
SMILESCNc1cc(S(=O)(=O)N(C)CCO)ccn1
InChIInChI=1S/C9H15N3O3S/c1-10-9-7-8(3-4-11-9)16(14,15)12(2)5-6-13/h3-4,7,13H,5-6H2,1-2H3,(H,10,11)
InChIKeyHCTXYFNBBIBUMR-UHFFFAOYSA-N
MW245.30 g/mol
LogP-0.26
Rot. Bonds5

About N-(2-hydroxyethyl)-N-methyl-2-(methylamino)pyridine-4-sulfonamide

N-(2-hydroxyethyl)-N-methyl-2-(methylamino)pyridine-4-sulfonamide (PubChem CID 62146541) has the molecular formula C9H15N3O3S and a molecular weight of 245.30 g/mol. Its IUPAC name is N-(2-hydroxyethyl)-N-methyl-2-(methylamino)pyridine-4-sulfonamide.

Molecular Properties

Compound NameN-(2-hydroxyethyl)-N-methyl-2-(methylamino)pyridine-4-sulfonamide
PubChem CID62146541
Molecular FormulaC9H15N3O3S
Molecular Weight245.30 g/mol
Exact Mass245.08
IUPAC NameN-(2-hydroxyethyl)-N-methyl-2-(methylamino)pyridine-4-sulfonamide
SMILESCNc1cc(S(=O)(=O)N(C)CCO)ccn1
InChIInChI=1S/C9H15N3O3S/c1-10-9-7-8(3-4-11-9)16(14,15)12(2)5-6-13/h3-4,7,13H,5-6H2,1-2H3,(H,10,11)
InChIKeyHCTXYFNBBIBUMR-UHFFFAOYSA-N
XLogP-0.26
TPSA82.53 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds5
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500245.30
LogP ≤ 5-0.26
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

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Related Compounds

N-(3-hydroxybutyl)-N-methyl-2-(methylamino)pyridine-4-sulfonamide
CID 113499863
N-methyl-2-(methylamino)-N-(3-methylsulfanylpropyl)pyridine-4-sulfonamide
CID 114238260
N-ethyl-2-(methylamino)-N-propylpyridine-4-sulfonamide
CID 62144437
N-methyl-2-(methylamino)-N-(4-methylphenyl)pyridine-4-sulfonamide
CID 62156970
N-(3,3-dimethylbutan-2-yl)-N-methyl-2-(methylamino)pyridine-4-sulfonamide
CID 62146399
2-hydrazinyl-N-(2-hydroxyethyl)-N-methylquinoline-6-sulfonamide
CID 60961716
N-methyl-2-(methylamino)pyridine-4-sulfonamide
CID 62148302
N-(2-hydroxyethyl)-N-methyl-3-(methylamino)pyridine-2-sulfonamide
CID 103304973
N-cyclopropyl-2-(methylamino)-N-propylpyridine-4-sulfonamide
CID 62144804
4-bromo-3-fluoro-N-(2-hydroxyethyl)-N-methylbenzenesulfonamide
CID 103833706
N-benzyl-N-ethyl-2-(methylamino)pyridine-4-sulfonamide
CID 62144424
N-(3-fluorophenyl)-N-methyl-2-(methylamino)pyridine-4-sulfonamide
CID 62157049

Frequently Asked Questions

What is the IUPAC name of N-(2-hydroxyethyl)-N-methyl-2-(methylamino)pyridine-4-sulfonamide?
The IUPAC name of N-(2-hydroxyethyl)-N-methyl-2-(methylamino)pyridine-4-sulfonamide (CID 62146541) is N-(2-hydroxyethyl)-N-methyl-2-(methylamino)pyridine-4-sulfonamide.
What is the SMILES notation for N-(2-hydroxyethyl)-N-methyl-2-(methylamino)pyridine-4-sulfonamide?
The canonical SMILES for N-(2-hydroxyethyl)-N-methyl-2-(methylamino)pyridine-4-sulfonamide is CNc1cc(S(=O)(=O)N(C)CCO)ccn1.
What is the InChIKey of N-(2-hydroxyethyl)-N-methyl-2-(methylamino)pyridine-4-sulfonamide?
The InChIKey is HCTXYFNBBIBUMR-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H15N3O3S/c1-10-9-7-8(3-4-11-9)16(14,15)12(2)5-6-13/h3-4,7,13H,5-6H2,1-2H3,(H,10,11).
What are the key properties of N-(2-hydroxyethyl)-N-methyl-2-(methylamino)pyridine-4-sulfonamide?
N-(2-hydroxyethyl)-N-methyl-2-(methylamino)pyridine-4-sulfonamide has a molecular weight of 245.30 g/mol, XLogP of -0.26, 5 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2-hydroxyethyl)-N-methyl-2-(methylamino)pyridine-4-sulfonamide is sourced from PubChem (CID 62146541), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).