4-(2-amino-2-oxoethoxy)-3-(2-fluorophenyl)-N-(2-methylpropyl)benzamide

C19H21FN2O3 — CID 123915722

IUPAC4-(2-amino-2-oxoethoxy)-3-(2-fluorophenyl)-N-(2-methylpropyl)benzamide
SMILESCC(C)CNC(=O)c1ccc(OCC(N)=O)c(-c2ccccc2F)c1
InChIInChI=1S/C19H21FN2O3/c1-12(2)10-22-19(24)13-7-8-17(25-11-18(21)23)15(9-13)14-5-3-4-6-16(14)20/h3-9,12H,10-11H2,1-2H3,(H2,21,23)(H,22,24)
InChIKeyOWZMCBVBKAAYFX-UHFFFAOYSA-N
MW344.39 g/mol
LogP2.74
Rot. Bonds7

About 4-(2-amino-2-oxoethoxy)-3-(2-fluorophenyl)-N-(2-methylpropyl)benzamide

4-(2-amino-2-oxoethoxy)-3-(2-fluorophenyl)-N-(2-methylpropyl)benzamide (PubChem CID 123915722) has the molecular formula C19H21FN2O3 and a molecular weight of 344.39 g/mol. Its IUPAC name is 4-(2-amino-2-oxoethoxy)-3-(2-fluorophenyl)-N-(2-methylpropyl)benzamide.

Molecular Properties

Compound Name4-(2-amino-2-oxoethoxy)-3-(2-fluorophenyl)-N-(2-methylpropyl)benzamide
PubChem CID123915722
Molecular FormulaC19H21FN2O3
Molecular Weight344.39 g/mol
Exact Mass344.15
IUPAC Name4-(2-amino-2-oxoethoxy)-3-(2-fluorophenyl)-N-(2-methylpropyl)benzamide
SMILESCC(C)CNC(=O)c1ccc(OCC(N)=O)c(-c2ccccc2F)c1
InChIInChI=1S/C19H21FN2O3/c1-12(2)10-22-19(24)13-7-8-17(25-11-18(21)23)15(9-13)14-5-3-4-6-16(14)20/h3-9,12H,10-11H2,1-2H3,(H2,21,23)(H,22,24)
InChIKeyOWZMCBVBKAAYFX-UHFFFAOYSA-N
XLogP2.74
TPSA81.42 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds7
Heavy Atoms25
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500344.39
LogP ≤ 52.74
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 4-(2-amino-2-oxoethoxy)-3-(2-fluorophenyl)-N-(2-methylpropyl)benzamide?
The IUPAC name of 4-(2-amino-2-oxoethoxy)-3-(2-fluorophenyl)-N-(2-methylpropyl)benzamide (CID 123915722) is 4-(2-amino-2-oxoethoxy)-3-(2-fluorophenyl)-N-(2-methylpropyl)benzamide.
What is the SMILES notation for 4-(2-amino-2-oxoethoxy)-3-(2-fluorophenyl)-N-(2-methylpropyl)benzamide?
The canonical SMILES for 4-(2-amino-2-oxoethoxy)-3-(2-fluorophenyl)-N-(2-methylpropyl)benzamide is CC(C)CNC(=O)c1ccc(OCC(N)=O)c(-c2ccccc2F)c1.
What is the InChIKey of 4-(2-amino-2-oxoethoxy)-3-(2-fluorophenyl)-N-(2-methylpropyl)benzamide?
The InChIKey is OWZMCBVBKAAYFX-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H21FN2O3/c1-12(2)10-22-19(24)13-7-8-17(25-11-18(21)23)15(9-13)14-5-3-4-6-16(14)20/h3-9,12H,10-11H2,1-2H3,(H2,21,23)(H,22,24).
What are the key properties of 4-(2-amino-2-oxoethoxy)-3-(2-fluorophenyl)-N-(2-methylpropyl)benzamide?
4-(2-amino-2-oxoethoxy)-3-(2-fluorophenyl)-N-(2-methylpropyl)benzamide has a molecular weight of 344.39 g/mol, XLogP of 2.74, 7 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 4-(2-amino-2-oxoethoxy)-3-(2-fluorophenyl)-N-(2-methylpropyl)benzamide is sourced from PubChem (CID 123915722), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).