2-[1-(4-fluorophenyl)ethylamino]-N-(2-propan-2-ylphenyl)acetamide

C19H23FN2O — CID 4878604

IUPAC2-[1-(4-fluorophenyl)ethylamino]-N-(2-propan-2-ylphenyl)acetamide
SMILESCC(C)c1ccccc1NC(=O)CNC(C)c1ccc(F)cc1
InChIInChI=1S/C19H23FN2O/c1-13(2)17-6-4-5-7-18(17)22-19(23)12-21-14(3)15-8-10-16(20)11-9-15/h4-11,13-14,21H,12H2,1-3H3,(H,22,23)
InChIKeyWKBJWURPBIOZIL-UHFFFAOYSA-N
MW314.40 g/mol
LogP4.24
Rot. Bonds6

About 2-[1-(4-fluorophenyl)ethylamino]-N-(2-propan-2-ylphenyl)acetamide

2-[1-(4-fluorophenyl)ethylamino]-N-(2-propan-2-ylphenyl)acetamide (PubChem CID 4878604) has the molecular formula C19H23FN2O and a molecular weight of 314.40 g/mol. Its IUPAC name is 2-[1-(4-fluorophenyl)ethylamino]-N-(2-propan-2-ylphenyl)acetamide.

Molecular Properties

Compound Name2-[1-(4-fluorophenyl)ethylamino]-N-(2-propan-2-ylphenyl)acetamide
PubChem CID4878604
Molecular FormulaC19H23FN2O
Molecular Weight314.40 g/mol
Exact Mass314.18
IUPAC Name2-[1-(4-fluorophenyl)ethylamino]-N-(2-propan-2-ylphenyl)acetamide
SMILESCC(C)c1ccccc1NC(=O)CNC(C)c1ccc(F)cc1
InChIInChI=1S/C19H23FN2O/c1-13(2)17-6-4-5-7-18(17)22-19(23)12-21-14(3)15-8-10-16(20)11-9-15/h4-11,13-14,21H,12H2,1-3H3,(H,22,23)
InChIKeyWKBJWURPBIOZIL-UHFFFAOYSA-N
XLogP4.24
TPSA41.13 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds6
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500314.40
LogP ≤ 54.24
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 2-[1-(4-fluorophenyl)ethylamino]-N-(2-propan-2-ylphenyl)acetamide?
The IUPAC name of 2-[1-(4-fluorophenyl)ethylamino]-N-(2-propan-2-ylphenyl)acetamide (CID 4878604) is 2-[1-(4-fluorophenyl)ethylamino]-N-(2-propan-2-ylphenyl)acetamide.
What is the SMILES notation for 2-[1-(4-fluorophenyl)ethylamino]-N-(2-propan-2-ylphenyl)acetamide?
The canonical SMILES for 2-[1-(4-fluorophenyl)ethylamino]-N-(2-propan-2-ylphenyl)acetamide is CC(C)c1ccccc1NC(=O)CNC(C)c1ccc(F)cc1.
What is the InChIKey of 2-[1-(4-fluorophenyl)ethylamino]-N-(2-propan-2-ylphenyl)acetamide?
The InChIKey is WKBJWURPBIOZIL-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H23FN2O/c1-13(2)17-6-4-5-7-18(17)22-19(23)12-21-14(3)15-8-10-16(20)11-9-15/h4-11,13-14,21H,12H2,1-3H3,(H,22,23).
What are the key properties of 2-[1-(4-fluorophenyl)ethylamino]-N-(2-propan-2-ylphenyl)acetamide?
2-[1-(4-fluorophenyl)ethylamino]-N-(2-propan-2-ylphenyl)acetamide has a molecular weight of 314.40 g/mol, XLogP of 4.24, 6 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[1-(4-fluorophenyl)ethylamino]-N-(2-propan-2-ylphenyl)acetamide is sourced from PubChem (CID 4878604), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).