2-[3-(4-fluorophenyl)phenyl]-2-methoxypropanamide

C16H16FNO2 — CID 90757877

IUPAC2-[3-(4-fluorophenyl)phenyl]-2-methoxypropanamide
SMILESCOC(C)(C(N)=O)c1cccc(-c2ccc(F)cc2)c1
InChIInChI=1S/C16H16FNO2/c1-16(20-2,15(18)19)13-5-3-4-12(10-13)11-6-8-14(17)9-7-11/h3-10H,1-2H3,(H2,18,19)
InChIKeyDXRPRCRZAQOVON-UHFFFAOYSA-N
MW273.31 g/mol
LogP2.84
Rot. Bonds4

About 2-[3-(4-fluorophenyl)phenyl]-2-methoxypropanamide

2-[3-(4-fluorophenyl)phenyl]-2-methoxypropanamide (PubChem CID 90757877) has the molecular formula C16H16FNO2 and a molecular weight of 273.31 g/mol. Its IUPAC name is 2-[3-(4-fluorophenyl)phenyl]-2-methoxypropanamide.

Molecular Properties

Compound Name2-[3-(4-fluorophenyl)phenyl]-2-methoxypropanamide
PubChem CID90757877
Molecular FormulaC16H16FNO2
Molecular Weight273.31 g/mol
Exact Mass273.12
IUPAC Name2-[3-(4-fluorophenyl)phenyl]-2-methoxypropanamide
SMILESCOC(C)(C(N)=O)c1cccc(-c2ccc(F)cc2)c1
InChIInChI=1S/C16H16FNO2/c1-16(20-2,15(18)19)13-5-3-4-12(10-13)11-6-8-14(17)9-7-11/h3-10H,1-2H3,(H2,18,19)
InChIKeyDXRPRCRZAQOVON-UHFFFAOYSA-N
XLogP2.84
TPSA52.32 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500273.31
LogP ≤ 52.84
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 2-[3-(4-fluorophenyl)phenyl]-2-methoxypropanamide?
The IUPAC name of 2-[3-(4-fluorophenyl)phenyl]-2-methoxypropanamide (CID 90757877) is 2-[3-(4-fluorophenyl)phenyl]-2-methoxypropanamide.
What is the SMILES notation for 2-[3-(4-fluorophenyl)phenyl]-2-methoxypropanamide?
The canonical SMILES for 2-[3-(4-fluorophenyl)phenyl]-2-methoxypropanamide is COC(C)(C(N)=O)c1cccc(-c2ccc(F)cc2)c1.
What is the InChIKey of 2-[3-(4-fluorophenyl)phenyl]-2-methoxypropanamide?
The InChIKey is DXRPRCRZAQOVON-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H16FNO2/c1-16(20-2,15(18)19)13-5-3-4-12(10-13)11-6-8-14(17)9-7-11/h3-10H,1-2H3,(H2,18,19).
What are the key properties of 2-[3-(4-fluorophenyl)phenyl]-2-methoxypropanamide?
2-[3-(4-fluorophenyl)phenyl]-2-methoxypropanamide has a molecular weight of 273.31 g/mol, XLogP of 2.84, 4 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[3-(4-fluorophenyl)phenyl]-2-methoxypropanamide is sourced from PubChem (CID 90757877), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).