N-ethyl-N-(4-fluorophenyl)-2-(3-methoxyphenyl)acetamide

C17H18FNO2 — CID 60592511

IUPACN-ethyl-N-(4-fluorophenyl)-2-(3-methoxyphenyl)acetamide
SMILESCCN(C(=O)Cc1cccc(OC)c1)c1ccc(F)cc1
InChIInChI=1S/C17H18FNO2/c1-3-19(15-9-7-14(18)8-10-15)17(20)12-13-5-4-6-16(11-13)21-2/h4-11H,3,12H2,1-2H3
InChIKeyKBCKJVZKHNFSKN-UHFFFAOYSA-N
MW287.33 g/mol
LogP3.43
Rot. Bonds5

About N-ethyl-N-(4-fluorophenyl)-2-(3-methoxyphenyl)acetamide

N-ethyl-N-(4-fluorophenyl)-2-(3-methoxyphenyl)acetamide (PubChem CID 60592511) has the molecular formula C17H18FNO2 and a molecular weight of 287.33 g/mol. Its IUPAC name is N-ethyl-N-(4-fluorophenyl)-2-(3-methoxyphenyl)acetamide.

Molecular Properties

Compound NameN-ethyl-N-(4-fluorophenyl)-2-(3-methoxyphenyl)acetamide
PubChem CID60592511
Molecular FormulaC17H18FNO2
Molecular Weight287.33 g/mol
Exact Mass287.13
IUPAC NameN-ethyl-N-(4-fluorophenyl)-2-(3-methoxyphenyl)acetamide
SMILESCCN(C(=O)Cc1cccc(OC)c1)c1ccc(F)cc1
InChIInChI=1S/C17H18FNO2/c1-3-19(15-9-7-14(18)8-10-15)17(20)12-13-5-4-6-16(11-13)21-2/h4-11H,3,12H2,1-2H3
InChIKeyKBCKJVZKHNFSKN-UHFFFAOYSA-N
XLogP3.43
TPSA29.54 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds5
Heavy Atoms21
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500287.33
LogP ≤ 53.43
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of N-ethyl-N-(4-fluorophenyl)-2-(3-methoxyphenyl)acetamide?
The IUPAC name of N-ethyl-N-(4-fluorophenyl)-2-(3-methoxyphenyl)acetamide (CID 60592511) is N-ethyl-N-(4-fluorophenyl)-2-(3-methoxyphenyl)acetamide.
What is the SMILES notation for N-ethyl-N-(4-fluorophenyl)-2-(3-methoxyphenyl)acetamide?
The canonical SMILES for N-ethyl-N-(4-fluorophenyl)-2-(3-methoxyphenyl)acetamide is CCN(C(=O)Cc1cccc(OC)c1)c1ccc(F)cc1.
What is the InChIKey of N-ethyl-N-(4-fluorophenyl)-2-(3-methoxyphenyl)acetamide?
The InChIKey is KBCKJVZKHNFSKN-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H18FNO2/c1-3-19(15-9-7-14(18)8-10-15)17(20)12-13-5-4-6-16(11-13)21-2/h4-11H,3,12H2,1-2H3.
What are the key properties of N-ethyl-N-(4-fluorophenyl)-2-(3-methoxyphenyl)acetamide?
N-ethyl-N-(4-fluorophenyl)-2-(3-methoxyphenyl)acetamide has a molecular weight of 287.33 g/mol, XLogP of 3.43, 5 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-ethyl-N-(4-fluorophenyl)-2-(3-methoxyphenyl)acetamide is sourced from PubChem (CID 60592511), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).