N-[2-[[4-(4-fluorophenoxy)phenyl]methylamino]-2-oxoethyl]-2-phenylacetamide

C23H21FN2O3 — CID 25403563

IUPACN-[2-[[4-(4-fluorophenoxy)phenyl]methylamino]-2-oxoethyl]-2-phenylacetamide
SMILESO=C(CNC(=O)Cc1ccccc1)NCc1ccc(Oc2ccc(F)cc2)cc1
InChIInChI=1S/C23H21FN2O3/c24-19-8-12-21(13-9-19)29-20-10-6-18(7-11-20)15-25-23(28)16-26-22(27)14-17-4-2-1-3-5-17/h1-13H,14-16H2,(H,25,28)(H,26,27)
InChIKeyXDUIDCAGHVQGDV-UHFFFAOYSA-N
MW392.43 g/mol
LogP3.59
Rot. Bonds8

About N-[2-[[4-(4-fluorophenoxy)phenyl]methylamino]-2-oxoethyl]-2-phenylacetamide

N-[2-[[4-(4-fluorophenoxy)phenyl]methylamino]-2-oxoethyl]-2-phenylacetamide (PubChem CID 25403563) has the molecular formula C23H21FN2O3 and a molecular weight of 392.43 g/mol. Its IUPAC name is N-[2-[[4-(4-fluorophenoxy)phenyl]methylamino]-2-oxoethyl]-2-phenylacetamide.

Molecular Properties

Compound NameN-[2-[[4-(4-fluorophenoxy)phenyl]methylamino]-2-oxoethyl]-2-phenylacetamide
PubChem CID25403563
Molecular FormulaC23H21FN2O3
Molecular Weight392.43 g/mol
Exact Mass392.15
IUPAC NameN-[2-[[4-(4-fluorophenoxy)phenyl]methylamino]-2-oxoethyl]-2-phenylacetamide
SMILESO=C(CNC(=O)Cc1ccccc1)NCc1ccc(Oc2ccc(F)cc2)cc1
InChIInChI=1S/C23H21FN2O3/c24-19-8-12-21(13-9-19)29-20-10-6-18(7-11-20)15-25-23(28)16-26-22(27)14-17-4-2-1-3-5-17/h1-13H,14-16H2,(H,25,28)(H,26,27)
InChIKeyXDUIDCAGHVQGDV-UHFFFAOYSA-N
XLogP3.59
TPSA67.43 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds8
Heavy Atoms29
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500392.43
LogP ≤ 53.59
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

N-[[4-(4-fluorophenoxy)phenyl]methyl]-2-(methylamino)acetamide
CID 61260109
N-[2-[[4-(4-fluorophenoxy)phenyl]methylamino]-2-oxoethyl]-4-methylbenzamide
CID 24553132
2-[4-(benzylamino)phenyl]-N-[(4-fluorophenyl)methyl]acetamide
CID 42852618
2-(4-fluorophenyl)-N-[2-oxo-2-(2-phenylethylamino)ethyl]acetamide
CID 112993239
(4-fluorophenyl) 2-[(2-phenylacetyl)amino]acetate
CID 174646519
N-benzyl-2-[4-[(4-fluorophenyl)methylamino]phenyl]acetamide
CID 46045383
benzyl N-[2-[(4-fluorophenyl)methylamino]-2-oxoethyl]carbamate
CID 101435256
N-benzyl-N'-[(4-fluorophenyl)methyl]butanediamide
CID 91939014
N-[2-[(4-fluorophenyl)methylamino]-2-oxoethyl]-2-(3-methylphenyl)acetamide
CID 112992570
5-bromo-N-[2-[[4-(4-fluorophenoxy)phenyl]methylamino]-2-oxoethyl]thiophene-2-carboxamide
CID 52670386
N-benzyl-2-(4-methoxyphenyl)acetamide
CID 795936
2-(2-fluorophenyl)-N-[2-[(4-methoxyphenyl)methylamino]-2-oxoethyl]acetamide
CID 48502002

Frequently Asked Questions

What is the IUPAC name of N-[2-[[4-(4-fluorophenoxy)phenyl]methylamino]-2-oxoethyl]-2-phenylacetamide?
The IUPAC name of N-[2-[[4-(4-fluorophenoxy)phenyl]methylamino]-2-oxoethyl]-2-phenylacetamide (CID 25403563) is N-[2-[[4-(4-fluorophenoxy)phenyl]methylamino]-2-oxoethyl]-2-phenylacetamide.
What is the SMILES notation for N-[2-[[4-(4-fluorophenoxy)phenyl]methylamino]-2-oxoethyl]-2-phenylacetamide?
The canonical SMILES for N-[2-[[4-(4-fluorophenoxy)phenyl]methylamino]-2-oxoethyl]-2-phenylacetamide is O=C(CNC(=O)Cc1ccccc1)NCc1ccc(Oc2ccc(F)cc2)cc1.
What is the InChIKey of N-[2-[[4-(4-fluorophenoxy)phenyl]methylamino]-2-oxoethyl]-2-phenylacetamide?
The InChIKey is XDUIDCAGHVQGDV-UHFFFAOYSA-N. The full InChI is InChI=1S/C23H21FN2O3/c24-19-8-12-21(13-9-19)29-20-10-6-18(7-11-20)15-25-23(28)16-26-22(27)14-17-4-2-1-3-5-17/h1-13H,14-16H2,(H,25,28)(H,26,27).
What are the key properties of N-[2-[[4-(4-fluorophenoxy)phenyl]methylamino]-2-oxoethyl]-2-phenylacetamide?
N-[2-[[4-(4-fluorophenoxy)phenyl]methylamino]-2-oxoethyl]-2-phenylacetamide has a molecular weight of 392.43 g/mol, XLogP of 3.59, 8 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-[2-[[4-(4-fluorophenoxy)phenyl]methylamino]-2-oxoethyl]-2-phenylacetamide is sourced from PubChem (CID 25403563), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).