4-morpholin-4-ylsulfonyl-N-(pyridin-2-ylmethyl)benzamide

C17H19N3O4S — CID 8880641

IUPAC4-morpholin-4-ylsulfonyl-N-(pyridin-2-ylmethyl)benzamide
SMILESO=C(NCc1ccccn1)c1ccc(S(=O)(=O)N2CCOCC2)cc1
InChIInChI=1S/C17H19N3O4S/c21-17(19-13-15-3-1-2-8-18-15)14-4-6-16(7-5-14)25(22,23)20-9-11-24-12-10-20/h1-8H,9-13H2,(H,19,21)
InChIKeyUTTRQLGHTOTUQF-UHFFFAOYSA-N
MW361.42 g/mol
LogP1.03
Rot. Bonds5

About 4-morpholin-4-ylsulfonyl-N-(pyridin-2-ylmethyl)benzamide

4-morpholin-4-ylsulfonyl-N-(pyridin-2-ylmethyl)benzamide (PubChem CID 8880641) has the molecular formula C17H19N3O4S and a molecular weight of 361.42 g/mol. Its IUPAC name is 4-morpholin-4-ylsulfonyl-N-(pyridin-2-ylmethyl)benzamide.

Molecular Properties

Compound Name4-morpholin-4-ylsulfonyl-N-(pyridin-2-ylmethyl)benzamide
PubChem CID8880641
Molecular FormulaC17H19N3O4S
Molecular Weight361.42 g/mol
Exact Mass361.11
IUPAC Name4-morpholin-4-ylsulfonyl-N-(pyridin-2-ylmethyl)benzamide
SMILESO=C(NCc1ccccn1)c1ccc(S(=O)(=O)N2CCOCC2)cc1
InChIInChI=1S/C17H19N3O4S/c21-17(19-13-15-3-1-2-8-18-15)14-4-6-16(7-5-14)25(22,23)20-9-11-24-12-10-20/h1-8H,9-13H2,(H,19,21)
InChIKeyUTTRQLGHTOTUQF-UHFFFAOYSA-N
XLogP1.03
TPSA88.60 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds5
Heavy Atoms25
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500361.42
LogP ≤ 51.03
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Related Compounds

2-fluoro-5-morpholin-4-ylsulfonyl-N-(pyridin-2-ylmethyl)benzamide
CID 5143733
4-morpholin-4-ylsulfonyl-N-[[4-oxo-3-(pyridin-2-ylmethyl)phthalazin-1-yl]methyl]benzamide
CID 121049288
4-[(2R,6R)-2,6-dimethylmorpholin-4-yl]sulfonyl-N-(pyridin-2-ylmethyl)benzamide
CID 8880611
N-(pyridin-2-ylmethyl)-3-pyrrolidin-1-ylsulfonylbenzamide
CID 8880625
N-(imidazo[2,1-b][1,3]thiazol-6-ylmethyl)-4-morpholin-4-ylsulfonylbenzamide
CID 3887000
3-morpholin-4-ylsulfonyl-N-(pyrimidin-4-ylmethyl)benzamide
CID 77097656
N-[(5-cyclopropyl-1-methylpyrazol-3-yl)methyl]-4-morpholin-4-ylsulfonylbenzamide
CID 71808611
3-(4-ethylpiperazin-1-yl)sulfonyl-N-(pyridin-2-ylmethyl)benzamide
CID 109064311
N-[(4-methoxyphenyl)methyl]-4-morpholin-4-ylsulfonylbenzamide
CID 2429764
N-(1,3-benzodioxol-4-ylmethyl)-4-morpholin-4-ylsulfonylbenzamide
CID 171983012
N-[[4-oxo-3-(pyridin-2-ylmethyl)phthalazin-1-yl]methyl]-4-pyrrolidin-1-ylsulfonylbenzamide
CID 121049286
1-(4-methylphenyl)sulfonyl-N-(pyridin-2-ylmethyl)pyrrole-3-carboxamide
CID 146501073

Frequently Asked Questions

What is the IUPAC name of 4-morpholin-4-ylsulfonyl-N-(pyridin-2-ylmethyl)benzamide?
The IUPAC name of 4-morpholin-4-ylsulfonyl-N-(pyridin-2-ylmethyl)benzamide (CID 8880641) is 4-morpholin-4-ylsulfonyl-N-(pyridin-2-ylmethyl)benzamide.
What is the SMILES notation for 4-morpholin-4-ylsulfonyl-N-(pyridin-2-ylmethyl)benzamide?
The canonical SMILES for 4-morpholin-4-ylsulfonyl-N-(pyridin-2-ylmethyl)benzamide is O=C(NCc1ccccn1)c1ccc(S(=O)(=O)N2CCOCC2)cc1.
What is the InChIKey of 4-morpholin-4-ylsulfonyl-N-(pyridin-2-ylmethyl)benzamide?
The InChIKey is UTTRQLGHTOTUQF-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H19N3O4S/c21-17(19-13-15-3-1-2-8-18-15)14-4-6-16(7-5-14)25(22,23)20-9-11-24-12-10-20/h1-8H,9-13H2,(H,19,21).
What are the key properties of 4-morpholin-4-ylsulfonyl-N-(pyridin-2-ylmethyl)benzamide?
4-morpholin-4-ylsulfonyl-N-(pyridin-2-ylmethyl)benzamide has a molecular weight of 361.42 g/mol, XLogP of 1.03, 5 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 4-morpholin-4-ylsulfonyl-N-(pyridin-2-ylmethyl)benzamide is sourced from PubChem (CID 8880641), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).