2-[(4-chlorophenyl)sulfonyl-methylamino]-N-(6-methoxy-3-pyridinyl)acetamide

C15H16ClN3O4S — CID 2092308

IUPAC2-[(4-chlorophenyl)sulfonyl-methylamino]-N-(6-methoxy-3-pyridinyl)acetamide
SMILESCOc1ccc(NC(=O)CN(C)S(=O)(=O)c2ccc(Cl)cc2)cn1
InChIInChI=1S/C15H16ClN3O4S/c1-19(24(21,22)13-6-3-11(16)4-7-13)10-14(20)18-12-5-8-15(23-2)17-9-12/h3-9H,10H2,1-2H3,(H,18,20)
InChIKeyWARDBFMXWBYCPE-UHFFFAOYSA-N
MW369.83 g/mol
LogP2.00
Rot. Bonds6

About 2-[(4-chlorophenyl)sulfonyl-methylamino]-N-(6-methoxy-3-pyridinyl)acetamide

2-[(4-chlorophenyl)sulfonyl-methylamino]-N-(6-methoxy-3-pyridinyl)acetamide (PubChem CID 2092308) has the molecular formula C15H16ClN3O4S and a molecular weight of 369.83 g/mol. Its IUPAC name is 2-[(4-chlorophenyl)sulfonyl-methylamino]-N-(6-methoxy-3-pyridinyl)acetamide.

Molecular Properties

Compound Name2-[(4-chlorophenyl)sulfonyl-methylamino]-N-(6-methoxy-3-pyridinyl)acetamide
PubChem CID2092308
Molecular FormulaC15H16ClN3O4S
Molecular Weight369.83 g/mol
Exact Mass369.06
IUPAC Name2-[(4-chlorophenyl)sulfonyl-methylamino]-N-(6-methoxy-3-pyridinyl)acetamide
SMILESCOc1ccc(NC(=O)CN(C)S(=O)(=O)c2ccc(Cl)cc2)cn1
InChIInChI=1S/C15H16ClN3O4S/c1-19(24(21,22)13-6-3-11(16)4-7-13)10-14(20)18-12-5-8-15(23-2)17-9-12/h3-9H,10H2,1-2H3,(H,18,20)
InChIKeyWARDBFMXWBYCPE-UHFFFAOYSA-N
XLogP2.00
TPSA88.60 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds6
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500369.83
LogP ≤ 52.00
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Frequently Asked Questions

What is the IUPAC name of 2-[(4-chlorophenyl)sulfonyl-methylamino]-N-(6-methoxy-3-pyridinyl)acetamide?
The IUPAC name of 2-[(4-chlorophenyl)sulfonyl-methylamino]-N-(6-methoxy-3-pyridinyl)acetamide (CID 2092308) is 2-[(4-chlorophenyl)sulfonyl-methylamino]-N-(6-methoxy-3-pyridinyl)acetamide.
What is the SMILES notation for 2-[(4-chlorophenyl)sulfonyl-methylamino]-N-(6-methoxy-3-pyridinyl)acetamide?
The canonical SMILES for 2-[(4-chlorophenyl)sulfonyl-methylamino]-N-(6-methoxy-3-pyridinyl)acetamide is COc1ccc(NC(=O)CN(C)S(=O)(=O)c2ccc(Cl)cc2)cn1.
What is the InChIKey of 2-[(4-chlorophenyl)sulfonyl-methylamino]-N-(6-methoxy-3-pyridinyl)acetamide?
The InChIKey is WARDBFMXWBYCPE-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H16ClN3O4S/c1-19(24(21,22)13-6-3-11(16)4-7-13)10-14(20)18-12-5-8-15(23-2)17-9-12/h3-9H,10H2,1-2H3,(H,18,20).
What are the key properties of 2-[(4-chlorophenyl)sulfonyl-methylamino]-N-(6-methoxy-3-pyridinyl)acetamide?
2-[(4-chlorophenyl)sulfonyl-methylamino]-N-(6-methoxy-3-pyridinyl)acetamide has a molecular weight of 369.83 g/mol, XLogP of 2.00, 6 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[(4-chlorophenyl)sulfonyl-methylamino]-N-(6-methoxy-3-pyridinyl)acetamide is sourced from PubChem (CID 2092308), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).