2-[(4-methoxyphenyl)sulfonylamino]-N-quinolin-2-ylacetamide

C18H17N3O4S — CID 17398529

IUPAC2-[(4-methoxyphenyl)sulfonylamino]-N-quinolin-2-ylacetamide
SMILESCOc1ccc(S(=O)(=O)NCC(=O)Nc2ccc3ccccc3n2)cc1
InChIInChI=1S/C18H17N3O4S/c1-25-14-7-9-15(10-8-14)26(23,24)19-12-18(22)21-17-11-6-13-4-2-3-5-16(13)20-17/h2-11,19H,12H2,1H3,(H,20,21,22)
InChIKeyYOFNZTZGUVSNPL-UHFFFAOYSA-N
MW371.42 g/mol
LogP2.16
Rot. Bonds6

About 2-[(4-methoxyphenyl)sulfonylamino]-N-quinolin-2-ylacetamide

2-[(4-methoxyphenyl)sulfonylamino]-N-quinolin-2-ylacetamide (PubChem CID 17398529) has the molecular formula C18H17N3O4S and a molecular weight of 371.42 g/mol. Its IUPAC name is 2-[(4-methoxyphenyl)sulfonylamino]-N-quinolin-2-ylacetamide.

Molecular Properties

Compound Name2-[(4-methoxyphenyl)sulfonylamino]-N-quinolin-2-ylacetamide
PubChem CID17398529
Molecular FormulaC18H17N3O4S
Molecular Weight371.42 g/mol
Exact Mass371.09
IUPAC Name2-[(4-methoxyphenyl)sulfonylamino]-N-quinolin-2-ylacetamide
SMILESCOc1ccc(S(=O)(=O)NCC(=O)Nc2ccc3ccccc3n2)cc1
InChIInChI=1S/C18H17N3O4S/c1-25-14-7-9-15(10-8-14)26(23,24)19-12-18(22)21-17-11-6-13-4-2-3-5-16(13)20-17/h2-11,19H,12H2,1H3,(H,20,21,22)
InChIKeyYOFNZTZGUVSNPL-UHFFFAOYSA-N
XLogP2.16
TPSA97.39 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds6
Heavy Atoms26
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500371.42
LogP ≤ 52.16
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

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Frequently Asked Questions

What is the IUPAC name of 2-[(4-methoxyphenyl)sulfonylamino]-N-quinolin-2-ylacetamide?
The IUPAC name of 2-[(4-methoxyphenyl)sulfonylamino]-N-quinolin-2-ylacetamide (CID 17398529) is 2-[(4-methoxyphenyl)sulfonylamino]-N-quinolin-2-ylacetamide.
What is the SMILES notation for 2-[(4-methoxyphenyl)sulfonylamino]-N-quinolin-2-ylacetamide?
The canonical SMILES for 2-[(4-methoxyphenyl)sulfonylamino]-N-quinolin-2-ylacetamide is COc1ccc(S(=O)(=O)NCC(=O)Nc2ccc3ccccc3n2)cc1.
What is the InChIKey of 2-[(4-methoxyphenyl)sulfonylamino]-N-quinolin-2-ylacetamide?
The InChIKey is YOFNZTZGUVSNPL-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H17N3O4S/c1-25-14-7-9-15(10-8-14)26(23,24)19-12-18(22)21-17-11-6-13-4-2-3-5-16(13)20-17/h2-11,19H,12H2,1H3,(H,20,21,22).
What are the key properties of 2-[(4-methoxyphenyl)sulfonylamino]-N-quinolin-2-ylacetamide?
2-[(4-methoxyphenyl)sulfonylamino]-N-quinolin-2-ylacetamide has a molecular weight of 371.42 g/mol, XLogP of 2.16, 6 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[(4-methoxyphenyl)sulfonylamino]-N-quinolin-2-ylacetamide is sourced from PubChem (CID 17398529), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).