5-chloro-2-hydroxy-N-[[2-(morpholin-4-ylsulfonylmethyl)phenyl]methyl]benzamide

C19H21ClN2O5S — CID 18120484

IUPAC5-chloro-2-hydroxy-N-[[2-(morpholin-4-ylsulfonylmethyl)phenyl]methyl]benzamide
SMILESO=C(NCc1ccccc1CS(=O)(=O)N1CCOCC1)c1cc(Cl)ccc1O
InChIInChI=1S/C19H21ClN2O5S/c20-16-5-6-18(23)17(11-16)19(24)21-12-14-3-1-2-4-15(14)13-28(25,26)22-7-9-27-10-8-22/h1-6,11,23H,7-10,12-13H2,(H,21,24)
InChIKeyOCYFUKDRJXAGKY-UHFFFAOYSA-N
MW424.91 g/mol
LogP2.14
Rot. Bonds6

About 5-chloro-2-hydroxy-N-[[2-(morpholin-4-ylsulfonylmethyl)phenyl]methyl]benzamide

5-chloro-2-hydroxy-N-[[2-(morpholin-4-ylsulfonylmethyl)phenyl]methyl]benzamide (PubChem CID 18120484) has the molecular formula C19H21ClN2O5S and a molecular weight of 424.91 g/mol. Its IUPAC name is 5-chloro-2-hydroxy-N-[[2-(morpholin-4-ylsulfonylmethyl)phenyl]methyl]benzamide.

Molecular Properties

Compound Name5-chloro-2-hydroxy-N-[[2-(morpholin-4-ylsulfonylmethyl)phenyl]methyl]benzamide
PubChem CID18120484
Molecular FormulaC19H21ClN2O5S
Molecular Weight424.91 g/mol
Exact Mass424.09
IUPAC Name5-chloro-2-hydroxy-N-[[2-(morpholin-4-ylsulfonylmethyl)phenyl]methyl]benzamide
SMILESO=C(NCc1ccccc1CS(=O)(=O)N1CCOCC1)c1cc(Cl)ccc1O
InChIInChI=1S/C19H21ClN2O5S/c20-16-5-6-18(23)17(11-16)19(24)21-12-14-3-1-2-4-15(14)13-28(25,26)22-7-9-27-10-8-22/h1-6,11,23H,7-10,12-13H2,(H,21,24)
InChIKeyOCYFUKDRJXAGKY-UHFFFAOYSA-N
XLogP2.14
TPSA95.94 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds6
Heavy Atoms28
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500424.91
LogP ≤ 52.14
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

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Related Compounds

5-chloro-N-[[2-(morpholin-4-ylsulfonylmethyl)phenyl]methyl]-1-benzofuran-2-carboxamide
CID 27702531
2,5-dimethyl-N-[[2-(morpholin-4-ylsulfonylmethyl)phenyl]methyl]benzamide
CID 24535412
2-methyl-N-[[2-(morpholin-4-ylsulfonylmethyl)phenyl]methyl]benzamide
CID 24541772
2,6-dichloro-N-[[2-(morpholin-4-ylsulfonylmethyl)phenyl]methyl]benzamide
CID 112803399
3-methyl-N-[[2-(morpholin-4-ylsulfonylmethyl)phenyl]methyl]benzamide
CID 17409313
1-amino-N-[[2-(morpholin-4-ylsulfonylmethyl)phenyl]methyl]cyclopropane-1-carboxamide;hydrochloride
CID 119697559
N-[[2-(morpholin-4-ylsulfonylmethyl)phenyl]methyl]-5,6,7,8-tetrahydronaphthalene-2-carboxamide
CID 24541809
N-[[2-(morpholin-4-ylsulfonylmethyl)phenyl]methyl]-2,3-dihydro-1H-indene-5-carboxamide
CID 24541794
N-[2-[[2-(morpholin-4-ylsulfonylmethyl)phenyl]methylcarbamoyl]phenyl]furan-2-carboxamide
CID 24553156
1-amino-N-[[2-(morpholin-4-ylsulfonylmethyl)phenyl]methyl]cyclopentane-1-carboxamide
CID 119275552
3-methyl-N-[[2-(morpholin-4-ylsulfonylmethyl)phenyl]methyl]furan-2-carboxamide
CID 17408204
N-[[2-(morpholin-4-ylsulfonylmethyl)phenyl]methyl]-4-pyrrol-1-ylbenzamide
CID 24541820

Frequently Asked Questions

What is the IUPAC name of 5-chloro-2-hydroxy-N-[[2-(morpholin-4-ylsulfonylmethyl)phenyl]methyl]benzamide?
The IUPAC name of 5-chloro-2-hydroxy-N-[[2-(morpholin-4-ylsulfonylmethyl)phenyl]methyl]benzamide (CID 18120484) is 5-chloro-2-hydroxy-N-[[2-(morpholin-4-ylsulfonylmethyl)phenyl]methyl]benzamide.
What is the SMILES notation for 5-chloro-2-hydroxy-N-[[2-(morpholin-4-ylsulfonylmethyl)phenyl]methyl]benzamide?
The canonical SMILES for 5-chloro-2-hydroxy-N-[[2-(morpholin-4-ylsulfonylmethyl)phenyl]methyl]benzamide is O=C(NCc1ccccc1CS(=O)(=O)N1CCOCC1)c1cc(Cl)ccc1O.
What is the InChIKey of 5-chloro-2-hydroxy-N-[[2-(morpholin-4-ylsulfonylmethyl)phenyl]methyl]benzamide?
The InChIKey is OCYFUKDRJXAGKY-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H21ClN2O5S/c20-16-5-6-18(23)17(11-16)19(24)21-12-14-3-1-2-4-15(14)13-28(25,26)22-7-9-27-10-8-22/h1-6,11,23H,7-10,12-13H2,(H,21,24).
What are the key properties of 5-chloro-2-hydroxy-N-[[2-(morpholin-4-ylsulfonylmethyl)phenyl]methyl]benzamide?
5-chloro-2-hydroxy-N-[[2-(morpholin-4-ylsulfonylmethyl)phenyl]methyl]benzamide has a molecular weight of 424.91 g/mol, XLogP of 2.14, 6 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 5-chloro-2-hydroxy-N-[[2-(morpholin-4-ylsulfonylmethyl)phenyl]methyl]benzamide is sourced from PubChem (CID 18120484), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).