2-(2-fluorophenoxy)-N-[[2-(4-methylphenyl)-1,3-thiazol-4-yl]methyl]propanamide

C20H19FN2O2S — CID 23613064

IUPAC2-(2-fluorophenoxy)-N-[[2-(4-methylphenyl)-1,3-thiazol-4-yl]methyl]propanamide
SMILESCc1ccc(-c2nc(CNC(=O)C(C)Oc3ccccc3F)cs2)cc1
InChIInChI=1S/C20H19FN2O2S/c1-13-7-9-15(10-8-13)20-23-16(12-26-20)11-22-19(24)14(2)25-18-6-4-3-5-17(18)21/h3-10,12,14H,11H2,1-2H3,(H,22,24)
InChIKeyRBCONUFEXBDLNW-UHFFFAOYSA-N
MW370.45 g/mol
LogP4.34
Rot. Bonds6

About 2-(2-fluorophenoxy)-N-[[2-(4-methylphenyl)-1,3-thiazol-4-yl]methyl]propanamide

2-(2-fluorophenoxy)-N-[[2-(4-methylphenyl)-1,3-thiazol-4-yl]methyl]propanamide (PubChem CID 23613064) has the molecular formula C20H19FN2O2S and a molecular weight of 370.45 g/mol. Its IUPAC name is 2-(2-fluorophenoxy)-N-[[2-(4-methylphenyl)-1,3-thiazol-4-yl]methyl]propanamide.

Molecular Properties

Compound Name2-(2-fluorophenoxy)-N-[[2-(4-methylphenyl)-1,3-thiazol-4-yl]methyl]propanamide
PubChem CID23613064
Molecular FormulaC20H19FN2O2S
Molecular Weight370.45 g/mol
Exact Mass370.12
IUPAC Name2-(2-fluorophenoxy)-N-[[2-(4-methylphenyl)-1,3-thiazol-4-yl]methyl]propanamide
SMILESCc1ccc(-c2nc(CNC(=O)C(C)Oc3ccccc3F)cs2)cc1
InChIInChI=1S/C20H19FN2O2S/c1-13-7-9-15(10-8-13)20-23-16(12-26-20)11-22-19(24)14(2)25-18-6-4-3-5-17(18)21/h3-10,12,14H,11H2,1-2H3,(H,22,24)
InChIKeyRBCONUFEXBDLNW-UHFFFAOYSA-N
XLogP4.34
TPSA51.22 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds6
Heavy Atoms26
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500370.45
LogP ≤ 54.34
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of 2-(2-fluorophenoxy)-N-[[2-(4-methylphenyl)-1,3-thiazol-4-yl]methyl]propanamide?
The IUPAC name of 2-(2-fluorophenoxy)-N-[[2-(4-methylphenyl)-1,3-thiazol-4-yl]methyl]propanamide (CID 23613064) is 2-(2-fluorophenoxy)-N-[[2-(4-methylphenyl)-1,3-thiazol-4-yl]methyl]propanamide.
What is the SMILES notation for 2-(2-fluorophenoxy)-N-[[2-(4-methylphenyl)-1,3-thiazol-4-yl]methyl]propanamide?
The canonical SMILES for 2-(2-fluorophenoxy)-N-[[2-(4-methylphenyl)-1,3-thiazol-4-yl]methyl]propanamide is Cc1ccc(-c2nc(CNC(=O)C(C)Oc3ccccc3F)cs2)cc1.
What is the InChIKey of 2-(2-fluorophenoxy)-N-[[2-(4-methylphenyl)-1,3-thiazol-4-yl]methyl]propanamide?
The InChIKey is RBCONUFEXBDLNW-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H19FN2O2S/c1-13-7-9-15(10-8-13)20-23-16(12-26-20)11-22-19(24)14(2)25-18-6-4-3-5-17(18)21/h3-10,12,14H,11H2,1-2H3,(H,22,24).
What are the key properties of 2-(2-fluorophenoxy)-N-[[2-(4-methylphenyl)-1,3-thiazol-4-yl]methyl]propanamide?
2-(2-fluorophenoxy)-N-[[2-(4-methylphenyl)-1,3-thiazol-4-yl]methyl]propanamide has a molecular weight of 370.45 g/mol, XLogP of 4.34, 6 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(2-fluorophenoxy)-N-[[2-(4-methylphenyl)-1,3-thiazol-4-yl]methyl]propanamide is sourced from PubChem (CID 23613064), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).