2-chloro-N-ethyl-N-(2-methoxyethyl)pyridine-3-sulfonamide

C10H15ClN2O3S — CID 54948785

IUPAC2-chloro-N-ethyl-N-(2-methoxyethyl)pyridine-3-sulfonamide
SMILESCCN(CCOC)S(=O)(=O)c1cccnc1Cl
InChIInChI=1S/C10H15ClN2O3S/c1-3-13(7-8-16-2)17(14,15)9-5-4-6-12-10(9)11/h4-6H,3,7-8H2,1-2H3
InChIKeyPNIBDZGXCTUBNA-UHFFFAOYSA-N
MW278.76 g/mol
LogP1.39
Rot. Bonds6

About 2-chloro-N-ethyl-N-(2-methoxyethyl)pyridine-3-sulfonamide

2-chloro-N-ethyl-N-(2-methoxyethyl)pyridine-3-sulfonamide (PubChem CID 54948785) has the molecular formula C10H15ClN2O3S and a molecular weight of 278.76 g/mol. Its IUPAC name is 2-chloro-N-ethyl-N-(2-methoxyethyl)pyridine-3-sulfonamide.

Molecular Properties

Compound Name2-chloro-N-ethyl-N-(2-methoxyethyl)pyridine-3-sulfonamide
PubChem CID54948785
Molecular FormulaC10H15ClN2O3S
Molecular Weight278.76 g/mol
Exact Mass278.05
IUPAC Name2-chloro-N-ethyl-N-(2-methoxyethyl)pyridine-3-sulfonamide
SMILESCCN(CCOC)S(=O)(=O)c1cccnc1Cl
InChIInChI=1S/C10H15ClN2O3S/c1-3-13(7-8-16-2)17(14,15)9-5-4-6-12-10(9)11/h4-6H,3,7-8H2,1-2H3
InChIKeyPNIBDZGXCTUBNA-UHFFFAOYSA-N
XLogP1.39
TPSA59.50 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds6
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500278.76
LogP ≤ 51.39
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

Structural Alerts{'alert_name': '2-halo_pyridine', 'substructure': 'N/A'}

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Related Compounds

2-chloro-N-(2-ethoxyethyl)-N-ethylpyridine-3-sulfonamide
CID 55226922
2-chloro-N-[3-(dimethylamino)propyl]-N-(2-methoxyethyl)pyridine-3-sulfonamide
CID 61046666
2-chloro-N-(2-cyanoethyl)-N-ethylpyridine-3-sulfonamide
CID 61046475
2-chloro-N-(cyclobutylmethyl)-N-ethylpyridine-3-sulfonamide
CID 107398331
2-chloro-N-hexyl-N-(2-hydroxyethyl)pyridine-3-sulfonamide
CID 61045189
2-hydrazinyl-N,N-bis(2-methoxyethyl)pyridine-3-sulfonamide
CID 61418313
2-chloro-N,N-bis[(4-methoxyphenyl)methyl]pyridine-3-sulfonamide;2-chloropyridine-3-sulfonyl chloride
CID 158526990
2-cyano-N-ethyl-N-(2-methoxyethyl)benzenesulfonamide
CID 61384582
2-chloro-N-methyl-N-pentylpyridine-3-sulfonamide
CID 43456976
2-[(2-chloro-3-pyridinyl)sulfonyl-ethylamino]-2-methylpropanoic acid
CID 62817489
2-amino-N,N-diethylpyridine-3-sulfonamide
CID 62150875
2-[(2-cyano-3-pyridinyl)sulfonyl-(2-methoxyethyl)amino]acetic acid
CID 106593294

Frequently Asked Questions

What is the IUPAC name of 2-chloro-N-ethyl-N-(2-methoxyethyl)pyridine-3-sulfonamide?
The IUPAC name of 2-chloro-N-ethyl-N-(2-methoxyethyl)pyridine-3-sulfonamide (CID 54948785) is 2-chloro-N-ethyl-N-(2-methoxyethyl)pyridine-3-sulfonamide.
What is the SMILES notation for 2-chloro-N-ethyl-N-(2-methoxyethyl)pyridine-3-sulfonamide?
The canonical SMILES for 2-chloro-N-ethyl-N-(2-methoxyethyl)pyridine-3-sulfonamide is CCN(CCOC)S(=O)(=O)c1cccnc1Cl.
What is the InChIKey of 2-chloro-N-ethyl-N-(2-methoxyethyl)pyridine-3-sulfonamide?
The InChIKey is PNIBDZGXCTUBNA-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H15ClN2O3S/c1-3-13(7-8-16-2)17(14,15)9-5-4-6-12-10(9)11/h4-6H,3,7-8H2,1-2H3.
What are the key properties of 2-chloro-N-ethyl-N-(2-methoxyethyl)pyridine-3-sulfonamide?
2-chloro-N-ethyl-N-(2-methoxyethyl)pyridine-3-sulfonamide has a molecular weight of 278.76 g/mol, XLogP of 1.39, 6 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-chloro-N-ethyl-N-(2-methoxyethyl)pyridine-3-sulfonamide is sourced from PubChem (CID 54948785), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).