2-hydroxy-N-(3-methoxyphenyl)-5-morpholin-4-ylsulfonylbenzamide

C18H20N2O6S — CID 43853473

IUPAC2-hydroxy-N-(3-methoxyphenyl)-5-morpholin-4-ylsulfonylbenzamide
SMILESCOc1cccc(NC(=O)c2cc(S(=O)(=O)N3CCOCC3)ccc2O)c1
InChIInChI=1S/C18H20N2O6S/c1-25-14-4-2-3-13(11-14)19-18(22)16-12-15(5-6-17(16)21)27(23,24)20-7-9-26-10-8-20/h2-6,11-12,21H,7-10H2,1H3,(H,19,22)
InChIKeyWAYXYDJMTVYPFJ-UHFFFAOYSA-N
MW392.43 g/mol
LogP1.67
Rot. Bonds5

About 2-hydroxy-N-(3-methoxyphenyl)-5-morpholin-4-ylsulfonylbenzamide

2-hydroxy-N-(3-methoxyphenyl)-5-morpholin-4-ylsulfonylbenzamide (PubChem CID 43853473) has the molecular formula C18H20N2O6S and a molecular weight of 392.43 g/mol. Its IUPAC name is 2-hydroxy-N-(3-methoxyphenyl)-5-morpholin-4-ylsulfonylbenzamide.

Molecular Properties

Compound Name2-hydroxy-N-(3-methoxyphenyl)-5-morpholin-4-ylsulfonylbenzamide
PubChem CID43853473
Molecular FormulaC18H20N2O6S
Molecular Weight392.43 g/mol
Exact Mass392.10
IUPAC Name2-hydroxy-N-(3-methoxyphenyl)-5-morpholin-4-ylsulfonylbenzamide
SMILESCOc1cccc(NC(=O)c2cc(S(=O)(=O)N3CCOCC3)ccc2O)c1
InChIInChI=1S/C18H20N2O6S/c1-25-14-4-2-3-13(11-14)19-18(22)16-12-15(5-6-17(16)21)27(23,24)20-7-9-26-10-8-20/h2-6,11-12,21H,7-10H2,1H3,(H,19,22)
InChIKeyWAYXYDJMTVYPFJ-UHFFFAOYSA-N
XLogP1.67
TPSA105.17 Ų
H-Bond Donors2
H-Bond Acceptors6
Rotatable Bonds5
Heavy Atoms27
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500392.43
LogP ≤ 51.67
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 106

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Related Compounds

2-hydroxy-N-(3-methylphenyl)-5-morpholin-4-ylsulfonylbenzamide
CID 43853467
2-chloro-N-(3-methoxyphenyl)-5-pyrrolidin-1-ylsulfonylbenzamide
CID 26914552
2-chloro-N-(3-methoxyphenyl)-5-piperidin-1-ylsulfonylbenzamide
CID 26914652
N-(4-acetylphenyl)-2-hydroxy-5-morpholin-4-ylsulfonylbenzamide
CID 43853441
2-chloro-N-(3-methylphenyl)-5-morpholin-4-ylsulfonylbenzamide
CID 1119039
2-chloro-N-(3-chloro-4-methoxyphenyl)-5-morpholin-4-ylsulfonylbenzamide
CID 26822987
3-[(2-methyl-5-morpholin-4-ylsulfonylbenzoyl)amino]benzoic acid
CID 23761201
2-chloro-N-(3,4-dimethoxyphenyl)-5-morpholin-4-ylsulfonylbenzamide
CID 26364799
N-(3-methoxyphenyl)-3,5-dimethyl-4-morpholin-4-ylsulfonyl-1H-pyrrole-2-carboxamide
CID 53059573
(2S)-N-(3-methoxyphenyl)-2-(4-morpholin-4-ylsulfonylphenoxy)-2-phenylacetamide
CID 40814254
N-(3-acetylphenyl)-2-fluoro-5-morpholin-4-ylsulfonylbenzamide
CID 9095795
N-(2,4-dichlorophenyl)-2-hydroxy-5-morpholin-4-ylsulfonylbenzamide
CID 43853480

Frequently Asked Questions

What is the IUPAC name of 2-hydroxy-N-(3-methoxyphenyl)-5-morpholin-4-ylsulfonylbenzamide?
The IUPAC name of 2-hydroxy-N-(3-methoxyphenyl)-5-morpholin-4-ylsulfonylbenzamide (CID 43853473) is 2-hydroxy-N-(3-methoxyphenyl)-5-morpholin-4-ylsulfonylbenzamide.
What is the SMILES notation for 2-hydroxy-N-(3-methoxyphenyl)-5-morpholin-4-ylsulfonylbenzamide?
The canonical SMILES for 2-hydroxy-N-(3-methoxyphenyl)-5-morpholin-4-ylsulfonylbenzamide is COc1cccc(NC(=O)c2cc(S(=O)(=O)N3CCOCC3)ccc2O)c1.
What is the InChIKey of 2-hydroxy-N-(3-methoxyphenyl)-5-morpholin-4-ylsulfonylbenzamide?
The InChIKey is WAYXYDJMTVYPFJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H20N2O6S/c1-25-14-4-2-3-13(11-14)19-18(22)16-12-15(5-6-17(16)21)27(23,24)20-7-9-26-10-8-20/h2-6,11-12,21H,7-10H2,1H3,(H,19,22).
What are the key properties of 2-hydroxy-N-(3-methoxyphenyl)-5-morpholin-4-ylsulfonylbenzamide?
2-hydroxy-N-(3-methoxyphenyl)-5-morpholin-4-ylsulfonylbenzamide has a molecular weight of 392.43 g/mol, XLogP of 1.67, 5 rotatable bonds, 2 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 2-hydroxy-N-(3-methoxyphenyl)-5-morpholin-4-ylsulfonylbenzamide is sourced from PubChem (CID 43853473), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).