N-[2-[2-(4-fluorophenyl)ethylamino]-2-oxoethyl]-2-(3-methylphenyl)acetamide

C19H21FN2O2 — CID 112993407

IUPACN-[2-[2-(4-fluorophenyl)ethylamino]-2-oxoethyl]-2-(3-methylphenyl)acetamide
SMILESCc1cccc(CC(=O)NCC(=O)NCCc2ccc(F)cc2)c1
InChIInChI=1S/C19H21FN2O2/c1-14-3-2-4-16(11-14)12-18(23)22-13-19(24)21-10-9-15-5-7-17(20)8-6-15/h2-8,11H,9-10,12-13H2,1H3,(H,21,24)(H,22,23)
InChIKeyUYIAPWSCCJRHGE-UHFFFAOYSA-N
MW328.39 g/mol
LogP2.15
Rot. Bonds7

About N-[2-[2-(4-fluorophenyl)ethylamino]-2-oxoethyl]-2-(3-methylphenyl)acetamide

N-[2-[2-(4-fluorophenyl)ethylamino]-2-oxoethyl]-2-(3-methylphenyl)acetamide (PubChem CID 112993407) has the molecular formula C19H21FN2O2 and a molecular weight of 328.39 g/mol. Its IUPAC name is N-[2-[2-(4-fluorophenyl)ethylamino]-2-oxoethyl]-2-(3-methylphenyl)acetamide.

Molecular Properties

Compound NameN-[2-[2-(4-fluorophenyl)ethylamino]-2-oxoethyl]-2-(3-methylphenyl)acetamide
PubChem CID112993407
Molecular FormulaC19H21FN2O2
Molecular Weight328.39 g/mol
Exact Mass328.16
IUPAC NameN-[2-[2-(4-fluorophenyl)ethylamino]-2-oxoethyl]-2-(3-methylphenyl)acetamide
SMILESCc1cccc(CC(=O)NCC(=O)NCCc2ccc(F)cc2)c1
InChIInChI=1S/C19H21FN2O2/c1-14-3-2-4-16(11-14)12-18(23)22-13-19(24)21-10-9-15-5-7-17(20)8-6-15/h2-8,11H,9-10,12-13H2,1H3,(H,21,24)(H,22,23)
InChIKeyUYIAPWSCCJRHGE-UHFFFAOYSA-N
XLogP2.15
TPSA58.20 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds7
Heavy Atoms24
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500328.39
LogP ≤ 52.15
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of N-[2-[2-(4-fluorophenyl)ethylamino]-2-oxoethyl]-2-(3-methylphenyl)acetamide?
The IUPAC name of N-[2-[2-(4-fluorophenyl)ethylamino]-2-oxoethyl]-2-(3-methylphenyl)acetamide (CID 112993407) is N-[2-[2-(4-fluorophenyl)ethylamino]-2-oxoethyl]-2-(3-methylphenyl)acetamide.
What is the SMILES notation for N-[2-[2-(4-fluorophenyl)ethylamino]-2-oxoethyl]-2-(3-methylphenyl)acetamide?
The canonical SMILES for N-[2-[2-(4-fluorophenyl)ethylamino]-2-oxoethyl]-2-(3-methylphenyl)acetamide is Cc1cccc(CC(=O)NCC(=O)NCCc2ccc(F)cc2)c1.
What is the InChIKey of N-[2-[2-(4-fluorophenyl)ethylamino]-2-oxoethyl]-2-(3-methylphenyl)acetamide?
The InChIKey is UYIAPWSCCJRHGE-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H21FN2O2/c1-14-3-2-4-16(11-14)12-18(23)22-13-19(24)21-10-9-15-5-7-17(20)8-6-15/h2-8,11H,9-10,12-13H2,1H3,(H,21,24)(H,22,23).
What are the key properties of N-[2-[2-(4-fluorophenyl)ethylamino]-2-oxoethyl]-2-(3-methylphenyl)acetamide?
N-[2-[2-(4-fluorophenyl)ethylamino]-2-oxoethyl]-2-(3-methylphenyl)acetamide has a molecular weight of 328.39 g/mol, XLogP of 2.15, 7 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-[2-[2-(4-fluorophenyl)ethylamino]-2-oxoethyl]-2-(3-methylphenyl)acetamide is sourced from PubChem (CID 112993407), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).