N-[2-(2,6-difluoroanilino)-2-oxoethyl]-N-ethyl-2-phenylacetamide

C18H18F2N2O2 — CID 2413323

IUPACN-[2-(2,6-difluoroanilino)-2-oxoethyl]-N-ethyl-2-phenylacetamide
SMILESCCN(CC(=O)Nc1c(F)cccc1F)C(=O)Cc1ccccc1
InChIInChI=1S/C18H18F2N2O2/c1-2-22(17(24)11-13-7-4-3-5-8-13)12-16(23)21-18-14(19)9-6-10-15(18)20/h3-10H,2,11-12H2,1H3,(H,21,23)
InChIKeyPEAAKTUGOZXFHZ-UHFFFAOYSA-N
MW332.35 g/mol
LogP2.99
Rot. Bonds6

About N-[2-(2,6-difluoroanilino)-2-oxoethyl]-N-ethyl-2-phenylacetamide

N-[2-(2,6-difluoroanilino)-2-oxoethyl]-N-ethyl-2-phenylacetamide (PubChem CID 2413323) has the molecular formula C18H18F2N2O2 and a molecular weight of 332.35 g/mol. Its IUPAC name is N-[2-(2,6-difluoroanilino)-2-oxoethyl]-N-ethyl-2-phenylacetamide.

Molecular Properties

Compound NameN-[2-(2,6-difluoroanilino)-2-oxoethyl]-N-ethyl-2-phenylacetamide
PubChem CID2413323
Molecular FormulaC18H18F2N2O2
Molecular Weight332.35 g/mol
Exact Mass332.13
IUPAC NameN-[2-(2,6-difluoroanilino)-2-oxoethyl]-N-ethyl-2-phenylacetamide
SMILESCCN(CC(=O)Nc1c(F)cccc1F)C(=O)Cc1ccccc1
InChIInChI=1S/C18H18F2N2O2/c1-2-22(17(24)11-13-7-4-3-5-8-13)12-16(23)21-18-14(19)9-6-10-15(18)20/h3-10H,2,11-12H2,1H3,(H,21,23)
InChIKeyPEAAKTUGOZXFHZ-UHFFFAOYSA-N
XLogP2.99
TPSA49.41 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds6
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500332.35
LogP ≤ 52.99
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of N-[2-(2,6-difluoroanilino)-2-oxoethyl]-N-ethyl-2-phenylacetamide?
The IUPAC name of N-[2-(2,6-difluoroanilino)-2-oxoethyl]-N-ethyl-2-phenylacetamide (CID 2413323) is N-[2-(2,6-difluoroanilino)-2-oxoethyl]-N-ethyl-2-phenylacetamide.
What is the SMILES notation for N-[2-(2,6-difluoroanilino)-2-oxoethyl]-N-ethyl-2-phenylacetamide?
The canonical SMILES for N-[2-(2,6-difluoroanilino)-2-oxoethyl]-N-ethyl-2-phenylacetamide is CCN(CC(=O)Nc1c(F)cccc1F)C(=O)Cc1ccccc1.
What is the InChIKey of N-[2-(2,6-difluoroanilino)-2-oxoethyl]-N-ethyl-2-phenylacetamide?
The InChIKey is PEAAKTUGOZXFHZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H18F2N2O2/c1-2-22(17(24)11-13-7-4-3-5-8-13)12-16(23)21-18-14(19)9-6-10-15(18)20/h3-10H,2,11-12H2,1H3,(H,21,23).
What are the key properties of N-[2-(2,6-difluoroanilino)-2-oxoethyl]-N-ethyl-2-phenylacetamide?
N-[2-(2,6-difluoroanilino)-2-oxoethyl]-N-ethyl-2-phenylacetamide has a molecular weight of 332.35 g/mol, XLogP of 2.99, 6 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-[2-(2,6-difluoroanilino)-2-oxoethyl]-N-ethyl-2-phenylacetamide is sourced from PubChem (CID 2413323), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).