2-[4-(2-fluoro-6-methoxyphenyl)phenyl]-2-methylpropanamide

C17H18FNO2 — CID 56713578

IUPAC2-[4-(2-fluoro-6-methoxyphenyl)phenyl]-2-methylpropanamide
SMILESCOc1cccc(F)c1-c1ccc(C(C)(C)C(N)=O)cc1
InChIInChI=1S/C17H18FNO2/c1-17(2,16(19)20)12-9-7-11(8-10-12)15-13(18)5-4-6-14(15)21-3/h4-10H,1-3H3,(H2,19,20)
InChIKeyUUVLNVYAYNMIGN-UHFFFAOYSA-N
MW287.33 g/mol
LogP3.26
Rot. Bonds4

About 2-[4-(2-fluoro-6-methoxyphenyl)phenyl]-2-methylpropanamide

2-[4-(2-fluoro-6-methoxyphenyl)phenyl]-2-methylpropanamide (PubChem CID 56713578) has the molecular formula C17H18FNO2 and a molecular weight of 287.33 g/mol. Its IUPAC name is 2-[4-(2-fluoro-6-methoxyphenyl)phenyl]-2-methylpropanamide.

Molecular Properties

Compound Name2-[4-(2-fluoro-6-methoxyphenyl)phenyl]-2-methylpropanamide
PubChem CID56713578
Molecular FormulaC17H18FNO2
Molecular Weight287.33 g/mol
Exact Mass287.13
IUPAC Name2-[4-(2-fluoro-6-methoxyphenyl)phenyl]-2-methylpropanamide
SMILESCOc1cccc(F)c1-c1ccc(C(C)(C)C(N)=O)cc1
InChIInChI=1S/C17H18FNO2/c1-17(2,16(19)20)12-9-7-11(8-10-12)15-13(18)5-4-6-14(15)21-3/h4-10H,1-3H3,(H2,19,20)
InChIKeyUUVLNVYAYNMIGN-UHFFFAOYSA-N
XLogP3.26
TPSA52.32 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500287.33
LogP ≤ 53.26
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 2-[4-(2-fluoro-6-methoxyphenyl)phenyl]-2-methylpropanamide?
The IUPAC name of 2-[4-(2-fluoro-6-methoxyphenyl)phenyl]-2-methylpropanamide (CID 56713578) is 2-[4-(2-fluoro-6-methoxyphenyl)phenyl]-2-methylpropanamide.
What is the SMILES notation for 2-[4-(2-fluoro-6-methoxyphenyl)phenyl]-2-methylpropanamide?
The canonical SMILES for 2-[4-(2-fluoro-6-methoxyphenyl)phenyl]-2-methylpropanamide is COc1cccc(F)c1-c1ccc(C(C)(C)C(N)=O)cc1.
What is the InChIKey of 2-[4-(2-fluoro-6-methoxyphenyl)phenyl]-2-methylpropanamide?
The InChIKey is UUVLNVYAYNMIGN-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H18FNO2/c1-17(2,16(19)20)12-9-7-11(8-10-12)15-13(18)5-4-6-14(15)21-3/h4-10H,1-3H3,(H2,19,20).
What are the key properties of 2-[4-(2-fluoro-6-methoxyphenyl)phenyl]-2-methylpropanamide?
2-[4-(2-fluoro-6-methoxyphenyl)phenyl]-2-methylpropanamide has a molecular weight of 287.33 g/mol, XLogP of 3.26, 4 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[4-(2-fluoro-6-methoxyphenyl)phenyl]-2-methylpropanamide is sourced from PubChem (CID 56713578), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).