4-fluoro-N-[2-oxo-2-[[phenyl(1,3-thiazol-2-yl)methyl]amino]ethyl]benzamide

C19H16FN3O2S — CID 44579234

IUPAC4-fluoro-N-[2-oxo-2-[[phenyl(1,3-thiazol-2-yl)methyl]amino]ethyl]benzamide
SMILESO=C(CNC(=O)c1ccc(F)cc1)NC(c1ccccc1)c1nccs1
InChIInChI=1S/C19H16FN3O2S/c20-15-8-6-14(7-9-15)18(25)22-12-16(24)23-17(19-21-10-11-26-19)13-4-2-1-3-5-13/h1-11,17H,12H2,(H,22,25)(H,23,24)
InChIKeySYBPXZBWAAAJAX-UHFFFAOYSA-N
MW369.42 g/mol
LogP2.92
Rot. Bonds6

About 4-fluoro-N-[2-oxo-2-[[phenyl(1,3-thiazol-2-yl)methyl]amino]ethyl]benzamide

4-fluoro-N-[2-oxo-2-[[phenyl(1,3-thiazol-2-yl)methyl]amino]ethyl]benzamide (PubChem CID 44579234) has the molecular formula C19H16FN3O2S and a molecular weight of 369.42 g/mol. Its IUPAC name is 4-fluoro-N-[2-oxo-2-[[phenyl(1,3-thiazol-2-yl)methyl]amino]ethyl]benzamide.

Molecular Properties

Compound Name4-fluoro-N-[2-oxo-2-[[phenyl(1,3-thiazol-2-yl)methyl]amino]ethyl]benzamide
PubChem CID44579234
Molecular FormulaC19H16FN3O2S
Molecular Weight369.42 g/mol
Exact Mass369.09
IUPAC Name4-fluoro-N-[2-oxo-2-[[phenyl(1,3-thiazol-2-yl)methyl]amino]ethyl]benzamide
SMILESO=C(CNC(=O)c1ccc(F)cc1)NC(c1ccccc1)c1nccs1
InChIInChI=1S/C19H16FN3O2S/c20-15-8-6-14(7-9-15)18(25)22-12-16(24)23-17(19-21-10-11-26-19)13-4-2-1-3-5-13/h1-11,17H,12H2,(H,22,25)(H,23,24)
InChIKeySYBPXZBWAAAJAX-UHFFFAOYSA-N
XLogP2.92
TPSA71.09 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds6
Heavy Atoms26
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500369.42
LogP ≤ 52.92
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of 4-fluoro-N-[2-oxo-2-[[phenyl(1,3-thiazol-2-yl)methyl]amino]ethyl]benzamide?
The IUPAC name of 4-fluoro-N-[2-oxo-2-[[phenyl(1,3-thiazol-2-yl)methyl]amino]ethyl]benzamide (CID 44579234) is 4-fluoro-N-[2-oxo-2-[[phenyl(1,3-thiazol-2-yl)methyl]amino]ethyl]benzamide.
What is the SMILES notation for 4-fluoro-N-[2-oxo-2-[[phenyl(1,3-thiazol-2-yl)methyl]amino]ethyl]benzamide?
The canonical SMILES for 4-fluoro-N-[2-oxo-2-[[phenyl(1,3-thiazol-2-yl)methyl]amino]ethyl]benzamide is O=C(CNC(=O)c1ccc(F)cc1)NC(c1ccccc1)c1nccs1.
What is the InChIKey of 4-fluoro-N-[2-oxo-2-[[phenyl(1,3-thiazol-2-yl)methyl]amino]ethyl]benzamide?
The InChIKey is SYBPXZBWAAAJAX-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H16FN3O2S/c20-15-8-6-14(7-9-15)18(25)22-12-16(24)23-17(19-21-10-11-26-19)13-4-2-1-3-5-13/h1-11,17H,12H2,(H,22,25)(H,23,24).
What are the key properties of 4-fluoro-N-[2-oxo-2-[[phenyl(1,3-thiazol-2-yl)methyl]amino]ethyl]benzamide?
4-fluoro-N-[2-oxo-2-[[phenyl(1,3-thiazol-2-yl)methyl]amino]ethyl]benzamide has a molecular weight of 369.42 g/mol, XLogP of 2.92, 6 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 4-fluoro-N-[2-oxo-2-[[phenyl(1,3-thiazol-2-yl)methyl]amino]ethyl]benzamide is sourced from PubChem (CID 44579234), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).