N-(3-fluorophenyl)-2-(2-oxo-4-phenylpyrrolidin-1-yl)acetamide

C18H17FN2O2 — CID 5309363

IUPACN-(3-fluorophenyl)-2-(2-oxo-4-phenylpyrrolidin-1-yl)acetamide
SMILESO=C(CN1CC(c2ccccc2)CC1=O)Nc1cccc(F)c1
InChIInChI=1S/C18H17FN2O2/c19-15-7-4-8-16(10-15)20-17(22)12-21-11-14(9-18(21)23)13-5-2-1-3-6-13/h1-8,10,14H,9,11-12H2,(H,20,22)
InChIKeyNNTZETQYCAZKJF-UHFFFAOYSA-N
MW312.34 g/mol
LogP2.78
Rot. Bonds4

About N-(3-fluorophenyl)-2-(2-oxo-4-phenylpyrrolidin-1-yl)acetamide

N-(3-fluorophenyl)-2-(2-oxo-4-phenylpyrrolidin-1-yl)acetamide (PubChem CID 5309363) has the molecular formula C18H17FN2O2 and a molecular weight of 312.34 g/mol. Its IUPAC name is N-(3-fluorophenyl)-2-(2-oxo-4-phenylpyrrolidin-1-yl)acetamide.

Molecular Properties

Compound NameN-(3-fluorophenyl)-2-(2-oxo-4-phenylpyrrolidin-1-yl)acetamide
PubChem CID5309363
Molecular FormulaC18H17FN2O2
Molecular Weight312.34 g/mol
Exact Mass312.13
IUPAC NameN-(3-fluorophenyl)-2-(2-oxo-4-phenylpyrrolidin-1-yl)acetamide
SMILESO=C(CN1CC(c2ccccc2)CC1=O)Nc1cccc(F)c1
InChIInChI=1S/C18H17FN2O2/c19-15-7-4-8-16(10-15)20-17(22)12-21-11-14(9-18(21)23)13-5-2-1-3-6-13/h1-8,10,14H,9,11-12H2,(H,20,22)
InChIKeyNNTZETQYCAZKJF-UHFFFAOYSA-N
XLogP2.78
TPSA49.41 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500312.34
LogP ≤ 52.78
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of N-(3-fluorophenyl)-2-(2-oxo-4-phenylpyrrolidin-1-yl)acetamide?
The IUPAC name of N-(3-fluorophenyl)-2-(2-oxo-4-phenylpyrrolidin-1-yl)acetamide (CID 5309363) is N-(3-fluorophenyl)-2-(2-oxo-4-phenylpyrrolidin-1-yl)acetamide.
What is the SMILES notation for N-(3-fluorophenyl)-2-(2-oxo-4-phenylpyrrolidin-1-yl)acetamide?
The canonical SMILES for N-(3-fluorophenyl)-2-(2-oxo-4-phenylpyrrolidin-1-yl)acetamide is O=C(CN1CC(c2ccccc2)CC1=O)Nc1cccc(F)c1.
What is the InChIKey of N-(3-fluorophenyl)-2-(2-oxo-4-phenylpyrrolidin-1-yl)acetamide?
The InChIKey is NNTZETQYCAZKJF-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H17FN2O2/c19-15-7-4-8-16(10-15)20-17(22)12-21-11-14(9-18(21)23)13-5-2-1-3-6-13/h1-8,10,14H,9,11-12H2,(H,20,22).
What are the key properties of N-(3-fluorophenyl)-2-(2-oxo-4-phenylpyrrolidin-1-yl)acetamide?
N-(3-fluorophenyl)-2-(2-oxo-4-phenylpyrrolidin-1-yl)acetamide has a molecular weight of 312.34 g/mol, XLogP of 2.78, 4 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-(3-fluorophenyl)-2-(2-oxo-4-phenylpyrrolidin-1-yl)acetamide is sourced from PubChem (CID 5309363), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).