2-(2,4-difluorophenyl)sulfanyl-N-[4-(morpholin-4-ylmethyl)phenyl]acetamide

C19H20F2N2O2S — CID 8771186

IUPAC2-(2,4-difluorophenyl)sulfanyl-N-[4-(morpholin-4-ylmethyl)phenyl]acetamide
SMILESO=C(CSc1ccc(F)cc1F)Nc1ccc(CN2CCOCC2)cc1
InChIInChI=1S/C19H20F2N2O2S/c20-15-3-6-18(17(21)11-15)26-13-19(24)22-16-4-1-14(2-5-16)12-23-7-9-25-10-8-23/h1-6,11H,7-10,12-13H2,(H,22,24)
InChIKeyGCKRSXBUNVTITG-UHFFFAOYSA-N
MW378.44 g/mol
LogP3.53
Rot. Bonds6

About 2-(2,4-difluorophenyl)sulfanyl-N-[4-(morpholin-4-ylmethyl)phenyl]acetamide

2-(2,4-difluorophenyl)sulfanyl-N-[4-(morpholin-4-ylmethyl)phenyl]acetamide (PubChem CID 8771186) has the molecular formula C19H20F2N2O2S and a molecular weight of 378.44 g/mol. Its IUPAC name is 2-(2,4-difluorophenyl)sulfanyl-N-[4-(morpholin-4-ylmethyl)phenyl]acetamide.

Molecular Properties

Compound Name2-(2,4-difluorophenyl)sulfanyl-N-[4-(morpholin-4-ylmethyl)phenyl]acetamide
PubChem CID8771186
Molecular FormulaC19H20F2N2O2S
Molecular Weight378.44 g/mol
Exact Mass378.12
IUPAC Name2-(2,4-difluorophenyl)sulfanyl-N-[4-(morpholin-4-ylmethyl)phenyl]acetamide
SMILESO=C(CSc1ccc(F)cc1F)Nc1ccc(CN2CCOCC2)cc1
InChIInChI=1S/C19H20F2N2O2S/c20-15-3-6-18(17(21)11-15)26-13-19(24)22-16-4-1-14(2-5-16)12-23-7-9-25-10-8-23/h1-6,11H,7-10,12-13H2,(H,22,24)
InChIKeyGCKRSXBUNVTITG-UHFFFAOYSA-N
XLogP3.53
TPSA41.57 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds6
Heavy Atoms26
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500378.44
LogP ≤ 53.53
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

2-(2,5-difluorophenyl)sulfanyl-N-[4-(pyrrolidin-1-ylmethyl)phenyl]acetamide
CID 8871255
2-(2,4-difluorophenoxy)-N-[4-(morpholin-4-ylmethyl)phenyl]acetamide
CID 24629949
2,4-difluoro-N-[4-(morpholin-4-ylmethyl)phenyl]benzamide
CID 108731005
2,5-difluoro-N-[4-(morpholin-4-ylmethyl)phenyl]benzamide
CID 78802644
2-(4-acetamidophenyl)sulfanyl-N-[4-(morpholin-4-ylmethyl)phenyl]acetamide
CID 26599953
2-amino-N-[4-(morpholin-4-ylmethyl)phenyl]acetamide
CID 60672694
2-[(4,5-dimethyl-1,2,4-triazol-3-yl)sulfanyl]-N-[4-(morpholin-4-ylmethyl)phenyl]acetamide
CID 17445227
2-[(5-amino-1,3,4-thiadiazol-2-yl)sulfanyl]-N-[4-(morpholin-4-ylmethyl)phenyl]acetamide
CID 9199575
2-(4-fluorophenyl)sulfanyl-N-(4-morpholin-4-ylphenyl)acetamide
CID 2994341
N-(3,4-diethoxyphenyl)-2-(2,4-difluorophenyl)sulfanylacetamide
CID 9046452
2-methoxy-N-[4-(morpholin-4-ylmethyl)phenyl]acetamide
CID 60656764
2-(2,4-dichlorophenoxy)-N-[4-(morpholin-4-ylmethyl)phenyl]acetamide
CID 979211

Frequently Asked Questions

What is the IUPAC name of 2-(2,4-difluorophenyl)sulfanyl-N-[4-(morpholin-4-ylmethyl)phenyl]acetamide?
The IUPAC name of 2-(2,4-difluorophenyl)sulfanyl-N-[4-(morpholin-4-ylmethyl)phenyl]acetamide (CID 8771186) is 2-(2,4-difluorophenyl)sulfanyl-N-[4-(morpholin-4-ylmethyl)phenyl]acetamide.
What is the SMILES notation for 2-(2,4-difluorophenyl)sulfanyl-N-[4-(morpholin-4-ylmethyl)phenyl]acetamide?
The canonical SMILES for 2-(2,4-difluorophenyl)sulfanyl-N-[4-(morpholin-4-ylmethyl)phenyl]acetamide is O=C(CSc1ccc(F)cc1F)Nc1ccc(CN2CCOCC2)cc1.
What is the InChIKey of 2-(2,4-difluorophenyl)sulfanyl-N-[4-(morpholin-4-ylmethyl)phenyl]acetamide?
The InChIKey is GCKRSXBUNVTITG-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H20F2N2O2S/c20-15-3-6-18(17(21)11-15)26-13-19(24)22-16-4-1-14(2-5-16)12-23-7-9-25-10-8-23/h1-6,11H,7-10,12-13H2,(H,22,24).
What are the key properties of 2-(2,4-difluorophenyl)sulfanyl-N-[4-(morpholin-4-ylmethyl)phenyl]acetamide?
2-(2,4-difluorophenyl)sulfanyl-N-[4-(morpholin-4-ylmethyl)phenyl]acetamide has a molecular weight of 378.44 g/mol, XLogP of 3.53, 6 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(2,4-difluorophenyl)sulfanyl-N-[4-(morpholin-4-ylmethyl)phenyl]acetamide is sourced from PubChem (CID 8771186), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).