N-[(4-fluorophenyl)methyl]acetamide

C9H10FNO — CID 3532104

IUPACN-[(4-fluorophenyl)methyl]acetamide
SMILESCC(=O)NCc1ccc(F)cc1
InChIInChI=1S/C9H10FNO/c1-7(12)11-6-8-2-4-9(10)5-3-8/h2-5H,6H2,1H3,(H,11,12)
InChIKeyIHNHPSHMZGCDCL-UHFFFAOYSA-N
MW167.18 g/mol
LogP1.46
Rot. Bonds2

About N-[(4-fluorophenyl)methyl]acetamide

N-[(4-fluorophenyl)methyl]acetamide (PubChem CID 3532104) has the molecular formula C9H10FNO and a molecular weight of 167.18 g/mol. Its IUPAC name is N-[(4-fluorophenyl)methyl]acetamide.

Molecular Properties

Compound NameN-[(4-fluorophenyl)methyl]acetamide
PubChem CID3532104
Molecular FormulaC9H10FNO
Molecular Weight167.18 g/mol
Exact Mass167.07
IUPAC NameN-[(4-fluorophenyl)methyl]acetamide
SMILESCC(=O)NCc1ccc(F)cc1
InChIInChI=1S/C9H10FNO/c1-7(12)11-6-8-2-4-9(10)5-3-8/h2-5H,6H2,1H3,(H,11,12)
InChIKeyIHNHPSHMZGCDCL-UHFFFAOYSA-N
XLogP1.46
TPSA29.10 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds2
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500167.18
LogP ≤ 51.46
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

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Frequently Asked Questions

What is the IUPAC name of N-[(4-fluorophenyl)methyl]acetamide?
The IUPAC name of N-[(4-fluorophenyl)methyl]acetamide (CID 3532104) is N-[(4-fluorophenyl)methyl]acetamide.
What is the SMILES notation for N-[(4-fluorophenyl)methyl]acetamide?
The canonical SMILES for N-[(4-fluorophenyl)methyl]acetamide is CC(=O)NCc1ccc(F)cc1.
What is the InChIKey of N-[(4-fluorophenyl)methyl]acetamide?
The InChIKey is IHNHPSHMZGCDCL-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H10FNO/c1-7(12)11-6-8-2-4-9(10)5-3-8/h2-5H,6H2,1H3,(H,11,12).
What are the key properties of N-[(4-fluorophenyl)methyl]acetamide?
N-[(4-fluorophenyl)methyl]acetamide has a molecular weight of 167.18 g/mol, XLogP of 1.46, 2 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for N-[(4-fluorophenyl)methyl]acetamide is sourced from PubChem (CID 3532104), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).