6-amino-5-chloro-N-ethyl-N-(2-methylphenyl)pyridine-3-sulfonamide

C14H16ClN3O2S — CID 64606773

IUPAC6-amino-5-chloro-N-ethyl-N-(2-methylphenyl)pyridine-3-sulfonamide
SMILESCCN(c1ccccc1C)S(=O)(=O)c1cnc(N)c(Cl)c1
InChIInChI=1S/C14H16ClN3O2S/c1-3-18(13-7-5-4-6-10(13)2)21(19,20)11-8-12(15)14(16)17-9-11/h4-9H,3H2,1-2H3,(H2,16,17)
InChIKeyTYEPNGHUPYFUFT-UHFFFAOYSA-N
MW325.82 g/mol
LogP2.84
Rot. Bonds4

About 6-amino-5-chloro-N-ethyl-N-(2-methylphenyl)pyridine-3-sulfonamide

6-amino-5-chloro-N-ethyl-N-(2-methylphenyl)pyridine-3-sulfonamide (PubChem CID 64606773) has the molecular formula C14H16ClN3O2S and a molecular weight of 325.82 g/mol. Its IUPAC name is 6-amino-5-chloro-N-ethyl-N-(2-methylphenyl)pyridine-3-sulfonamide.

Molecular Properties

Compound Name6-amino-5-chloro-N-ethyl-N-(2-methylphenyl)pyridine-3-sulfonamide
PubChem CID64606773
Molecular FormulaC14H16ClN3O2S
Molecular Weight325.82 g/mol
Exact Mass325.07
IUPAC Name6-amino-5-chloro-N-ethyl-N-(2-methylphenyl)pyridine-3-sulfonamide
SMILESCCN(c1ccccc1C)S(=O)(=O)c1cnc(N)c(Cl)c1
InChIInChI=1S/C14H16ClN3O2S/c1-3-18(13-7-5-4-6-10(13)2)21(19,20)11-8-12(15)14(16)17-9-11/h4-9H,3H2,1-2H3,(H2,16,17)
InChIKeyTYEPNGHUPYFUFT-UHFFFAOYSA-N
XLogP2.84
TPSA76.29 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500325.82
LogP ≤ 52.84
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of 6-amino-5-chloro-N-ethyl-N-(2-methylphenyl)pyridine-3-sulfonamide?
The IUPAC name of 6-amino-5-chloro-N-ethyl-N-(2-methylphenyl)pyridine-3-sulfonamide (CID 64606773) is 6-amino-5-chloro-N-ethyl-N-(2-methylphenyl)pyridine-3-sulfonamide.
What is the SMILES notation for 6-amino-5-chloro-N-ethyl-N-(2-methylphenyl)pyridine-3-sulfonamide?
The canonical SMILES for 6-amino-5-chloro-N-ethyl-N-(2-methylphenyl)pyridine-3-sulfonamide is CCN(c1ccccc1C)S(=O)(=O)c1cnc(N)c(Cl)c1.
What is the InChIKey of 6-amino-5-chloro-N-ethyl-N-(2-methylphenyl)pyridine-3-sulfonamide?
The InChIKey is TYEPNGHUPYFUFT-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H16ClN3O2S/c1-3-18(13-7-5-4-6-10(13)2)21(19,20)11-8-12(15)14(16)17-9-11/h4-9H,3H2,1-2H3,(H2,16,17).
What are the key properties of 6-amino-5-chloro-N-ethyl-N-(2-methylphenyl)pyridine-3-sulfonamide?
6-amino-5-chloro-N-ethyl-N-(2-methylphenyl)pyridine-3-sulfonamide has a molecular weight of 325.82 g/mol, XLogP of 2.84, 4 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 6-amino-5-chloro-N-ethyl-N-(2-methylphenyl)pyridine-3-sulfonamide is sourced from PubChem (CID 64606773), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).