3-(difluoromethoxy)-N-[2-oxo-2-(2-phenylethylamino)ethyl]benzamide

C18H18F2N2O3 — CID 51160991

IUPAC3-(difluoromethoxy)-N-[2-oxo-2-(2-phenylethylamino)ethyl]benzamide
SMILESO=C(CNC(=O)c1cccc(OC(F)F)c1)NCCc1ccccc1
InChIInChI=1S/C18H18F2N2O3/c19-18(20)25-15-8-4-7-14(11-15)17(24)22-12-16(23)21-10-9-13-5-2-1-3-6-13/h1-8,11,18H,9-10,12H2,(H,21,23)(H,22,24)
InChIKeyDUWQEVPUIZLLNH-UHFFFAOYSA-N
MW348.35 g/mol
LogP2.38
Rot. Bonds8

About 3-(difluoromethoxy)-N-[2-oxo-2-(2-phenylethylamino)ethyl]benzamide

3-(difluoromethoxy)-N-[2-oxo-2-(2-phenylethylamino)ethyl]benzamide (PubChem CID 51160991) has the molecular formula C18H18F2N2O3 and a molecular weight of 348.35 g/mol. Its IUPAC name is 3-(difluoromethoxy)-N-[2-oxo-2-(2-phenylethylamino)ethyl]benzamide.

Molecular Properties

Compound Name3-(difluoromethoxy)-N-[2-oxo-2-(2-phenylethylamino)ethyl]benzamide
PubChem CID51160991
Molecular FormulaC18H18F2N2O3
Molecular Weight348.35 g/mol
Exact Mass348.13
IUPAC Name3-(difluoromethoxy)-N-[2-oxo-2-(2-phenylethylamino)ethyl]benzamide
SMILESO=C(CNC(=O)c1cccc(OC(F)F)c1)NCCc1ccccc1
InChIInChI=1S/C18H18F2N2O3/c19-18(20)25-15-8-4-7-14(11-15)17(24)22-12-16(23)21-10-9-13-5-2-1-3-6-13/h1-8,11,18H,9-10,12H2,(H,21,23)(H,22,24)
InChIKeyDUWQEVPUIZLLNH-UHFFFAOYSA-N
XLogP2.38
TPSA67.43 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds8
Heavy Atoms25
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500348.35
LogP ≤ 52.38
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

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CID 55893056
N-benzyl-3-[2-[2-(4-fluorophenyl)ethylamino]-2-oxoethoxy]benzamide
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4-[[3-(difluoromethoxy)benzoyl]amino]-2-hydroxybutanoic acid
CID 107832660
3-chloro-N-[2-[2-(3-methoxyphenyl)ethylamino]-2-oxoethyl]benzamide
CID 112993552
N-[2-[2-(2-fluorophenyl)ethylamino]-2-oxoethyl]-3-methoxybenzamide
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3-(difluoromethoxy)-N-(2,2-dimethoxyethyl)benzamide
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Frequently Asked Questions

What is the IUPAC name of 3-(difluoromethoxy)-N-[2-oxo-2-(2-phenylethylamino)ethyl]benzamide?
The IUPAC name of 3-(difluoromethoxy)-N-[2-oxo-2-(2-phenylethylamino)ethyl]benzamide (CID 51160991) is 3-(difluoromethoxy)-N-[2-oxo-2-(2-phenylethylamino)ethyl]benzamide.
What is the SMILES notation for 3-(difluoromethoxy)-N-[2-oxo-2-(2-phenylethylamino)ethyl]benzamide?
The canonical SMILES for 3-(difluoromethoxy)-N-[2-oxo-2-(2-phenylethylamino)ethyl]benzamide is O=C(CNC(=O)c1cccc(OC(F)F)c1)NCCc1ccccc1.
What is the InChIKey of 3-(difluoromethoxy)-N-[2-oxo-2-(2-phenylethylamino)ethyl]benzamide?
The InChIKey is DUWQEVPUIZLLNH-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H18F2N2O3/c19-18(20)25-15-8-4-7-14(11-15)17(24)22-12-16(23)21-10-9-13-5-2-1-3-6-13/h1-8,11,18H,9-10,12H2,(H,21,23)(H,22,24).
What are the key properties of 3-(difluoromethoxy)-N-[2-oxo-2-(2-phenylethylamino)ethyl]benzamide?
3-(difluoromethoxy)-N-[2-oxo-2-(2-phenylethylamino)ethyl]benzamide has a molecular weight of 348.35 g/mol, XLogP of 2.38, 8 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 3-(difluoromethoxy)-N-[2-oxo-2-(2-phenylethylamino)ethyl]benzamide is sourced from PubChem (CID 51160991), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).