2-fluoro-N-[2-[(2-phenoxy-2-phenylacetyl)amino]ethyl]benzamide

C23H21FN2O3 — CID 55982811

IUPAC2-fluoro-N-[2-[(2-phenoxy-2-phenylacetyl)amino]ethyl]benzamide
SMILESO=C(NCCNC(=O)C(Oc1ccccc1)c1ccccc1)c1ccccc1F
InChIInChI=1S/C23H21FN2O3/c24-20-14-8-7-13-19(20)22(27)25-15-16-26-23(28)21(17-9-3-1-4-10-17)29-18-11-5-2-6-12-18/h1-14,21H,15-16H2,(H,25,27)(H,26,28)
InChIKeySSHFCVIKGLPRHW-UHFFFAOYSA-N
MW392.43 g/mol
LogP3.49
Rot. Bonds8

About 2-fluoro-N-[2-[(2-phenoxy-2-phenylacetyl)amino]ethyl]benzamide

2-fluoro-N-[2-[(2-phenoxy-2-phenylacetyl)amino]ethyl]benzamide (PubChem CID 55982811) has the molecular formula C23H21FN2O3 and a molecular weight of 392.43 g/mol. Its IUPAC name is 2-fluoro-N-[2-[(2-phenoxy-2-phenylacetyl)amino]ethyl]benzamide.

Molecular Properties

Compound Name2-fluoro-N-[2-[(2-phenoxy-2-phenylacetyl)amino]ethyl]benzamide
PubChem CID55982811
Molecular FormulaC23H21FN2O3
Molecular Weight392.43 g/mol
Exact Mass392.15
IUPAC Name2-fluoro-N-[2-[(2-phenoxy-2-phenylacetyl)amino]ethyl]benzamide
SMILESO=C(NCCNC(=O)C(Oc1ccccc1)c1ccccc1)c1ccccc1F
InChIInChI=1S/C23H21FN2O3/c24-20-14-8-7-13-19(20)22(27)25-15-16-26-23(28)21(17-9-3-1-4-10-17)29-18-11-5-2-6-12-18/h1-14,21H,15-16H2,(H,25,27)(H,26,28)
InChIKeySSHFCVIKGLPRHW-UHFFFAOYSA-N
XLogP3.49
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 ≤ 53.49
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Aliphatic_long_chain', 'substructure': 'N/A'}

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Related Compounds

N-[2-(2-aminopropanoylamino)ethyl]-2-fluorobenzamide;hydrochloride
CID 119299574
N-[2-(methylamino)ethyl]-2-phenyl-2-(3-propan-2-ylphenoxy)acetamide
CID 119500862
N-pentan-3-yl-2-phenoxy-2-phenylacetamide
CID 55752773
N-[(4-methoxyphenyl)methyl]-2-phenoxy-2-phenylacetamide
CID 46484867
[(1S)-2-(4-methylanilino)-2-oxo-1-phenylethyl] 2-[(2-fluorobenzoyl)amino]acetate
CID 9269936
[(1S)-2-(ethylcarbamoylamino)-2-oxo-1-phenylethyl] 2-[(2-fluorobenzoyl)amino]acetate
CID 9270601
3-[(2-fluorobenzoyl)amino]-2-phenylpropanoic acid
CID 62882788
N-[2-[(2-chlorobenzoyl)amino]ethyl]-2-fluorobenzamide
CID 108538189
N-[2-(ethylcarbamoylamino)ethyl]-2-fluorobenzamide
CID 47337929
2-fluoro-N-[2-[[(4-methoxyphenyl)-phenylmethyl]amino]-2-oxoethyl]benzamide
CID 24648997
2-(3,4-difluorophenoxy)-N-[2-(methylamino)propyl]-2-phenylacetamide
CID 120830171
2-fluoro-N-(4-methylpentyl)benzamide
CID 60738338

Frequently Asked Questions

What is the IUPAC name of 2-fluoro-N-[2-[(2-phenoxy-2-phenylacetyl)amino]ethyl]benzamide?
The IUPAC name of 2-fluoro-N-[2-[(2-phenoxy-2-phenylacetyl)amino]ethyl]benzamide (CID 55982811) is 2-fluoro-N-[2-[(2-phenoxy-2-phenylacetyl)amino]ethyl]benzamide.
What is the SMILES notation for 2-fluoro-N-[2-[(2-phenoxy-2-phenylacetyl)amino]ethyl]benzamide?
The canonical SMILES for 2-fluoro-N-[2-[(2-phenoxy-2-phenylacetyl)amino]ethyl]benzamide is O=C(NCCNC(=O)C(Oc1ccccc1)c1ccccc1)c1ccccc1F.
What is the InChIKey of 2-fluoro-N-[2-[(2-phenoxy-2-phenylacetyl)amino]ethyl]benzamide?
The InChIKey is SSHFCVIKGLPRHW-UHFFFAOYSA-N. The full InChI is InChI=1S/C23H21FN2O3/c24-20-14-8-7-13-19(20)22(27)25-15-16-26-23(28)21(17-9-3-1-4-10-17)29-18-11-5-2-6-12-18/h1-14,21H,15-16H2,(H,25,27)(H,26,28).
What are the key properties of 2-fluoro-N-[2-[(2-phenoxy-2-phenylacetyl)amino]ethyl]benzamide?
2-fluoro-N-[2-[(2-phenoxy-2-phenylacetyl)amino]ethyl]benzamide has a molecular weight of 392.43 g/mol, XLogP of 3.49, 8 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-fluoro-N-[2-[(2-phenoxy-2-phenylacetyl)amino]ethyl]benzamide is sourced from PubChem (CID 55982811), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).