N-[5-(2-methoxyethylamino)-2-pyridinyl]methanesulfonamide

C9H15N3O3S — CID 113025091

IUPACN-[5-(2-methoxyethylamino)-2-pyridinyl]methanesulfonamide
SMILESCOCCNc1ccc(NS(C)(=O)=O)nc1
InChIInChI=1S/C9H15N3O3S/c1-15-6-5-10-8-3-4-9(11-7-8)12-16(2,13)14/h3-4,7,10H,5-6H2,1-2H3,(H,11,12)
InChIKeyMYSTWCDSZZZVPT-UHFFFAOYSA-N
MW245.30 g/mol
LogP0.51
Rot. Bonds6

About N-[5-(2-methoxyethylamino)-2-pyridinyl]methanesulfonamide

N-[5-(2-methoxyethylamino)-2-pyridinyl]methanesulfonamide (PubChem CID 113025091) has the molecular formula C9H15N3O3S and a molecular weight of 245.30 g/mol. Its IUPAC name is N-[5-(2-methoxyethylamino)-2-pyridinyl]methanesulfonamide.

Molecular Properties

Compound NameN-[5-(2-methoxyethylamino)-2-pyridinyl]methanesulfonamide
PubChem CID113025091
Molecular FormulaC9H15N3O3S
Molecular Weight245.30 g/mol
Exact Mass245.08
IUPAC NameN-[5-(2-methoxyethylamino)-2-pyridinyl]methanesulfonamide
SMILESCOCCNc1ccc(NS(C)(=O)=O)nc1
InChIInChI=1S/C9H15N3O3S/c1-15-6-5-10-8-3-4-9(11-7-8)12-16(2,13)14/h3-4,7,10H,5-6H2,1-2H3,(H,11,12)
InChIKeyMYSTWCDSZZZVPT-UHFFFAOYSA-N
XLogP0.51
TPSA80.32 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds6
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500245.30
LogP ≤ 50.51
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Aliphatic_long_chain', 'substructure': 'N/A'}

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Related Compounds

N-[6-(2-methoxyethylamino)pyridazin-3-yl]methanesulfonamide
CID 113039467
4-methoxy-N-[5-(2-methoxyethylamino)-2-pyridinyl]-2,5-dimethylbenzenesulfonamide
CID 113025121
N-[6-(2-methoxyethylamino)-3-pyridinyl]benzenesulfonamide
CID 113010392
N-(5-methoxy-2-pyridinyl)methanesulfonamide
CID 67233634
N-[5-[2-(3-methoxyphenyl)ethylamino]-2-pyridinyl]methanesulfonamide
CID 113028442
5-hydrazinyl-N-(2-methoxyethyl)pyridin-2-amine
CID 55281043
N-[6-(2-methoxyethylamino)-3-pyridinyl]-3,5-dimethyl-1H-pyrazole-4-sulfonamide
CID 113010431
4-methoxy-N-[6-(2-methoxyethylamino)-3-pyridinyl]-2-methylbenzenesulfonamide
CID 113010409
4-fluoro-N-[6-(2-methoxyethylamino)-3-pyridinyl]-3-methylbenzenesulfonamide
CID 113010405
N-[6-(2-methoxyethylamino)-3-pyridinyl]-4-propan-2-ylbenzenesulfonamide
CID 113010403
2-chloro-N-[5-(3-methoxypropylamino)-2-pyridinyl]benzenesulfonamide
CID 113025271
N-[5-[2-(4-methoxyphenoxy)ethylamino]-2-pyridinyl]propane-1-sulfonamide
CID 113029927

Frequently Asked Questions

What is the IUPAC name of N-[5-(2-methoxyethylamino)-2-pyridinyl]methanesulfonamide?
The IUPAC name of N-[5-(2-methoxyethylamino)-2-pyridinyl]methanesulfonamide (CID 113025091) is N-[5-(2-methoxyethylamino)-2-pyridinyl]methanesulfonamide.
What is the SMILES notation for N-[5-(2-methoxyethylamino)-2-pyridinyl]methanesulfonamide?
The canonical SMILES for N-[5-(2-methoxyethylamino)-2-pyridinyl]methanesulfonamide is COCCNc1ccc(NS(C)(=O)=O)nc1.
What is the InChIKey of N-[5-(2-methoxyethylamino)-2-pyridinyl]methanesulfonamide?
The InChIKey is MYSTWCDSZZZVPT-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H15N3O3S/c1-15-6-5-10-8-3-4-9(11-7-8)12-16(2,13)14/h3-4,7,10H,5-6H2,1-2H3,(H,11,12).
What are the key properties of N-[5-(2-methoxyethylamino)-2-pyridinyl]methanesulfonamide?
N-[5-(2-methoxyethylamino)-2-pyridinyl]methanesulfonamide has a molecular weight of 245.30 g/mol, XLogP of 0.51, 6 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N-[5-(2-methoxyethylamino)-2-pyridinyl]methanesulfonamide is sourced from PubChem (CID 113025091), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).