2-(4-aminophenyl)-N-(3-fluoro-4-methoxyphenyl)acetamide

C15H15FN2O2 — CID 43380396

IUPAC2-(4-aminophenyl)-N-(3-fluoro-4-methoxyphenyl)acetamide
SMILESCOc1ccc(NC(=O)Cc2ccc(N)cc2)cc1F
InChIInChI=1S/C15H15FN2O2/c1-20-14-7-6-12(9-13(14)16)18-15(19)8-10-2-4-11(17)5-3-10/h2-7,9H,8,17H2,1H3,(H,18,19)
InChIKeyXBYRUJUYFTXLJI-UHFFFAOYSA-N
MW274.30 g/mol
LogP2.60
Rot. Bonds4

About 2-(4-aminophenyl)-N-(3-fluoro-4-methoxyphenyl)acetamide

2-(4-aminophenyl)-N-(3-fluoro-4-methoxyphenyl)acetamide (PubChem CID 43380396) has the molecular formula C15H15FN2O2 and a molecular weight of 274.30 g/mol. Its IUPAC name is 2-(4-aminophenyl)-N-(3-fluoro-4-methoxyphenyl)acetamide.

Molecular Properties

Compound Name2-(4-aminophenyl)-N-(3-fluoro-4-methoxyphenyl)acetamide
PubChem CID43380396
Molecular FormulaC15H15FN2O2
Molecular Weight274.30 g/mol
Exact Mass274.11
IUPAC Name2-(4-aminophenyl)-N-(3-fluoro-4-methoxyphenyl)acetamide
SMILESCOc1ccc(NC(=O)Cc2ccc(N)cc2)cc1F
InChIInChI=1S/C15H15FN2O2/c1-20-14-7-6-12(9-13(14)16)18-15(19)8-10-2-4-11(17)5-3-10/h2-7,9H,8,17H2,1H3,(H,18,19)
InChIKeyXBYRUJUYFTXLJI-UHFFFAOYSA-N
XLogP2.60
TPSA64.35 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500274.30
LogP ≤ 52.60
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'anil_no_alk(40)', 'substructure': 'N/A'}, {'alert_name': 'aniline', 'substructure': 'N/A'}

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Related Compounds

N-(3-fluoro-4-methoxyphenyl)-2-(4-methoxyphenyl)acetamide
CID 110776473
2-(4-aminophenyl)-N-(4-ethoxy-3-fluorophenyl)acetamide
CID 115738458
2-(3-fluoro-4-methoxyphenyl)-N-pyridin-4-ylacetamide
CID 39953694
3-(3-aminophenyl)-N-(3-fluoro-4-methoxyphenyl)propanamide
CID 43381050
N-(4-aminophenyl)-3-fluoro-4-methoxybenzamide
CID 55125214
3-(3-fluoro-4-methoxyphenyl)-N-(3-fluoro-4-methylphenyl)propanamide
CID 46657771
2-(3-fluoro-4-methoxyphenyl)-N-[4-(propan-2-ylcarbamoylamino)phenyl]acetamide
CID 38196743
N-[4-(difluoromethoxy)phenyl]-2-(3-fluoro-4-methoxyphenyl)acetamide
CID 9046569
[2-[[2-(3,4-difluoroanilino)-2-oxoethyl]amino]-2-oxoethyl] 2-(3-fluoro-4-methoxyphenyl)acetate
CID 8667599
2-(4-aminophenyl)-N-[3-[2-(cyclopropylamino)-2-oxoethoxy]-4-methoxyphenyl]acetamide;hydrochloride
CID 119717548
2-(4-bromophenyl)-N-(3,4-dimethoxyphenyl)acetamide
CID 2682877
2-[2-(3-fluoro-4-methoxyanilino)-2-oxoethyl]sulfanylacetic acid
CID 113427666

Frequently Asked Questions

What is the IUPAC name of 2-(4-aminophenyl)-N-(3-fluoro-4-methoxyphenyl)acetamide?
The IUPAC name of 2-(4-aminophenyl)-N-(3-fluoro-4-methoxyphenyl)acetamide (CID 43380396) is 2-(4-aminophenyl)-N-(3-fluoro-4-methoxyphenyl)acetamide.
What is the SMILES notation for 2-(4-aminophenyl)-N-(3-fluoro-4-methoxyphenyl)acetamide?
The canonical SMILES for 2-(4-aminophenyl)-N-(3-fluoro-4-methoxyphenyl)acetamide is COc1ccc(NC(=O)Cc2ccc(N)cc2)cc1F.
What is the InChIKey of 2-(4-aminophenyl)-N-(3-fluoro-4-methoxyphenyl)acetamide?
The InChIKey is XBYRUJUYFTXLJI-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H15FN2O2/c1-20-14-7-6-12(9-13(14)16)18-15(19)8-10-2-4-11(17)5-3-10/h2-7,9H,8,17H2,1H3,(H,18,19).
What are the key properties of 2-(4-aminophenyl)-N-(3-fluoro-4-methoxyphenyl)acetamide?
2-(4-aminophenyl)-N-(3-fluoro-4-methoxyphenyl)acetamide has a molecular weight of 274.30 g/mol, XLogP of 2.60, 4 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(4-aminophenyl)-N-(3-fluoro-4-methoxyphenyl)acetamide is sourced from PubChem (CID 43380396), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).