2-fluoro-N,N-dimethyl-2-phenylacetamide

C10H12FNO — CID 4111754

IUPAC2-fluoro-N,N-dimethyl-2-phenylacetamide
SMILESCN(C)C(=O)C(F)c1ccccc1
InChIInChI=1S/C10H12FNO/c1-12(2)10(13)9(11)8-6-4-3-5-7-8/h3-7,9H,1-2H3
InChIKeyWEIAJPQKIYHLGQ-UHFFFAOYSA-N
MW181.21 g/mol
LogP1.79
Rot. Bonds2

About 2-fluoro-N,N-dimethyl-2-phenylacetamide

2-fluoro-N,N-dimethyl-2-phenylacetamide (PubChem CID 4111754) has the molecular formula C10H12FNO and a molecular weight of 181.21 g/mol. Its IUPAC name is 2-fluoro-N,N-dimethyl-2-phenylacetamide.

Molecular Properties

Compound Name2-fluoro-N,N-dimethyl-2-phenylacetamide
PubChem CID4111754
Molecular FormulaC10H12FNO
Molecular Weight181.21 g/mol
Exact Mass181.09
IUPAC Name2-fluoro-N,N-dimethyl-2-phenylacetamide
SMILESCN(C)C(=O)C(F)c1ccccc1
InChIInChI=1S/C10H12FNO/c1-12(2)10(13)9(11)8-6-4-3-5-7-8/h3-7,9H,1-2H3
InChIKeyWEIAJPQKIYHLGQ-UHFFFAOYSA-N
XLogP1.79
TPSA20.31 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds2
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500181.21
LogP ≤ 51.79
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

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Frequently Asked Questions

What is the IUPAC name of 2-fluoro-N,N-dimethyl-2-phenylacetamide?
The IUPAC name of 2-fluoro-N,N-dimethyl-2-phenylacetamide (CID 4111754) is 2-fluoro-N,N-dimethyl-2-phenylacetamide.
What is the SMILES notation for 2-fluoro-N,N-dimethyl-2-phenylacetamide?
The canonical SMILES for 2-fluoro-N,N-dimethyl-2-phenylacetamide is CN(C)C(=O)C(F)c1ccccc1.
What is the InChIKey of 2-fluoro-N,N-dimethyl-2-phenylacetamide?
The InChIKey is WEIAJPQKIYHLGQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H12FNO/c1-12(2)10(13)9(11)8-6-4-3-5-7-8/h3-7,9H,1-2H3.
What are the key properties of 2-fluoro-N,N-dimethyl-2-phenylacetamide?
2-fluoro-N,N-dimethyl-2-phenylacetamide has a molecular weight of 181.21 g/mol, XLogP of 1.79, 2 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 2-fluoro-N,N-dimethyl-2-phenylacetamide is sourced from PubChem (CID 4111754), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).