2-ethoxy-2-fluoro-N-(1-phenylethyl)acetamide

C12H16FNO2 — CID 134893612

IUPAC2-ethoxy-2-fluoro-N-(1-phenylethyl)acetamide
SMILESCCOC(F)C(=O)NC(C)c1ccccc1
InChIInChI=1S/C12H16FNO2/c1-3-16-11(13)12(15)14-9(2)10-7-5-4-6-8-10/h4-9,11H,3H2,1-2H3,(H,14,15)
InChIKeyRVLWQIRUOSDEAG-UHFFFAOYSA-N
MW225.26 g/mol
LogP2.20
Rot. Bonds5

About 2-ethoxy-2-fluoro-N-(1-phenylethyl)acetamide

2-ethoxy-2-fluoro-N-(1-phenylethyl)acetamide (PubChem CID 134893612) has the molecular formula C12H16FNO2 and a molecular weight of 225.26 g/mol. Its IUPAC name is 2-ethoxy-2-fluoro-N-(1-phenylethyl)acetamide.

Molecular Properties

Compound Name2-ethoxy-2-fluoro-N-(1-phenylethyl)acetamide
PubChem CID134893612
Molecular FormulaC12H16FNO2
Molecular Weight225.26 g/mol
Exact Mass225.12
IUPAC Name2-ethoxy-2-fluoro-N-(1-phenylethyl)acetamide
SMILESCCOC(F)C(=O)NC(C)c1ccccc1
InChIInChI=1S/C12H16FNO2/c1-3-16-11(13)12(15)14-9(2)10-7-5-4-6-8-10/h4-9,11H,3H2,1-2H3,(H,14,15)
InChIKeyRVLWQIRUOSDEAG-UHFFFAOYSA-N
XLogP2.20
TPSA38.33 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds5
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500225.26
LogP ≤ 52.20
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

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Spm-6953
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N-benzyl-2-acetamido-3-methoxypropionamide
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N-(1-phenylethyl)acetamide
CID 222023
(R)-N-acetyl-1-phenylethylamine
CID 735802
[2-(Benzylamino)-2-oxoethyl] cyclopropanecarboxylate
CID 2079530
N-(1-phenylpropyl)oxolane-2-carboxamide
CID 6467126
N-(diphenylmethyl)-2-methoxyacetamide
CID 798780
[2-(Benzylamino)-2-oxoethyl] 2-methylprop-2-enoate
CID 2447792
N-(1-phenylethyl)morpholine-4-carboxamide
CID 3136314
2,2,2-trifluoro-N-(1-phenylethyl)acetamide
CID 529470

Frequently Asked Questions

What is the IUPAC name of 2-ethoxy-2-fluoro-N-(1-phenylethyl)acetamide?
The IUPAC name of 2-ethoxy-2-fluoro-N-(1-phenylethyl)acetamide (CID 134893612) is 2-ethoxy-2-fluoro-N-(1-phenylethyl)acetamide.
What is the SMILES notation for 2-ethoxy-2-fluoro-N-(1-phenylethyl)acetamide?
The canonical SMILES for 2-ethoxy-2-fluoro-N-(1-phenylethyl)acetamide is CCOC(F)C(=O)NC(C)c1ccccc1.
What is the InChIKey of 2-ethoxy-2-fluoro-N-(1-phenylethyl)acetamide?
The InChIKey is RVLWQIRUOSDEAG-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H16FNO2/c1-3-16-11(13)12(15)14-9(2)10-7-5-4-6-8-10/h4-9,11H,3H2,1-2H3,(H,14,15).
What are the key properties of 2-ethoxy-2-fluoro-N-(1-phenylethyl)acetamide?
2-ethoxy-2-fluoro-N-(1-phenylethyl)acetamide has a molecular weight of 225.26 g/mol, XLogP of 2.20, 5 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-ethoxy-2-fluoro-N-(1-phenylethyl)acetamide is sourced from PubChem (CID 134893612), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).