2-amino-1-(2-fluoro-4-methylphenyl)ethanone

C9H10FNO — CID 59233227

IUPAC2-amino-1-(2-fluoro-4-methylphenyl)ethanone
SMILESCc1ccc(C(=O)CN)c(F)c1
InChIInChI=1S/C9H10FNO/c1-6-2-3-7(8(10)4-6)9(12)5-11/h2-4H,5,11H2,1H3
InChIKeyUOCRNZCMUPDEIW-UHFFFAOYSA-N
MW167.18 g/mol
LogP1.28
Rot. Bonds2

About 2-amino-1-(2-fluoro-4-methylphenyl)ethanone

2-amino-1-(2-fluoro-4-methylphenyl)ethanone (PubChem CID 59233227) has the molecular formula C9H10FNO and a molecular weight of 167.18 g/mol. Its IUPAC name is 2-amino-1-(2-fluoro-4-methylphenyl)ethanone.

Molecular Properties

Compound Name2-amino-1-(2-fluoro-4-methylphenyl)ethanone
PubChem CID59233227
Molecular FormulaC9H10FNO
Molecular Weight167.18 g/mol
Exact Mass167.07
IUPAC Name2-amino-1-(2-fluoro-4-methylphenyl)ethanone
SMILESCc1ccc(C(=O)CN)c(F)c1
InChIInChI=1S/C9H10FNO/c1-6-2-3-7(8(10)4-6)9(12)5-11/h2-4H,5,11H2,1H3
InChIKeyUOCRNZCMUPDEIW-UHFFFAOYSA-N
XLogP1.28
TPSA43.09 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500167.18
LogP ≤ 51.28
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

1-(2-fluoro-4-methylphenyl)butan-1-one
CID 83957348
2-amino-1-(2-chloro-5-methylphenyl)ethanone
CID 83696787
2-(2,6-dimethylphenyl)-1-(2-fluoro-4-methylphenyl)ethanone
CID 115792574
1-(2-fluoro-4-methylphenyl)-3-methylbut-3-en-1-one
CID 115780535
2-amino-1-[2-(dimethylamino)-5-methylphenyl]ethanone
CID 117283238
1-(2-fluoro-4-methylphenyl)octan-1-one
CID 114966540
5-bromo-1-(2-fluoro-4-methylphenyl)pentan-1-one
CID 146010026
1-(2-fluoro-4-methylphenyl)-2-(4-fluoro-2-methylphenyl)ethanone
CID 115812673
3-cyclopropyl-1-(2-fluoro-4-methylphenyl)propan-1-one
CID 114978262
2-methoxyethyl 2-fluoro-4-methylbenzoate
CID 79872980
2-fluoro-N'-hydroxy-4-methylbenzenecarboximidamide
CID 125466399
2-amino-1-(4-chloro-2-fluoro-5-methylphenyl)ethanone
CID 130953142

Frequently Asked Questions

What is the IUPAC name of 2-amino-1-(2-fluoro-4-methylphenyl)ethanone?
The IUPAC name of 2-amino-1-(2-fluoro-4-methylphenyl)ethanone (CID 59233227) is 2-amino-1-(2-fluoro-4-methylphenyl)ethanone.
What is the SMILES notation for 2-amino-1-(2-fluoro-4-methylphenyl)ethanone?
The canonical SMILES for 2-amino-1-(2-fluoro-4-methylphenyl)ethanone is Cc1ccc(C(=O)CN)c(F)c1.
What is the InChIKey of 2-amino-1-(2-fluoro-4-methylphenyl)ethanone?
The InChIKey is UOCRNZCMUPDEIW-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H10FNO/c1-6-2-3-7(8(10)4-6)9(12)5-11/h2-4H,5,11H2,1H3.
What are the key properties of 2-amino-1-(2-fluoro-4-methylphenyl)ethanone?
2-amino-1-(2-fluoro-4-methylphenyl)ethanone has a molecular weight of 167.18 g/mol, XLogP of 1.28, 2 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-amino-1-(2-fluoro-4-methylphenyl)ethanone is sourced from PubChem (CID 59233227), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).