2-phenyl-N-(2-pyrrolidin-1-ylphenyl)acetamide

C18H20N2O — CID 890442

IUPAC2-phenyl-N-(2-pyrrolidin-1-ylphenyl)acetamide
SMILESO=C(Cc1ccccc1)Nc1ccccc1N1CCCC1
InChIInChI=1S/C18H20N2O/c21-18(14-15-8-2-1-3-9-15)19-16-10-4-5-11-17(16)20-12-6-7-13-20/h1-5,8-11H,6-7,12-14H2,(H,19,21)
InChIKeyLVPBIJNAMHEKDK-UHFFFAOYSA-N
MW280.37 g/mol
LogP3.47
Rot. Bonds4

About 2-phenyl-N-(2-pyrrolidin-1-ylphenyl)acetamide

2-phenyl-N-(2-pyrrolidin-1-ylphenyl)acetamide (PubChem CID 890442) has the molecular formula C18H20N2O and a molecular weight of 280.37 g/mol. Its IUPAC name is 2-phenyl-N-(2-pyrrolidin-1-ylphenyl)acetamide.

Molecular Properties

Compound Name2-phenyl-N-(2-pyrrolidin-1-ylphenyl)acetamide
PubChem CID890442
Molecular FormulaC18H20N2O
Molecular Weight280.37 g/mol
Exact Mass280.16
IUPAC Name2-phenyl-N-(2-pyrrolidin-1-ylphenyl)acetamide
SMILESO=C(Cc1ccccc1)Nc1ccccc1N1CCCC1
InChIInChI=1S/C18H20N2O/c21-18(14-15-8-2-1-3-9-15)19-16-10-4-5-11-17(16)20-12-6-7-13-20/h1-5,8-11H,6-7,12-14H2,(H,19,21)
InChIKeyLVPBIJNAMHEKDK-UHFFFAOYSA-N
XLogP3.47
TPSA32.34 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500280.37
LogP ≤ 53.47
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 2-phenyl-N-(2-pyrrolidin-1-ylphenyl)acetamide?
The IUPAC name of 2-phenyl-N-(2-pyrrolidin-1-ylphenyl)acetamide (CID 890442) is 2-phenyl-N-(2-pyrrolidin-1-ylphenyl)acetamide.
What is the SMILES notation for 2-phenyl-N-(2-pyrrolidin-1-ylphenyl)acetamide?
The canonical SMILES for 2-phenyl-N-(2-pyrrolidin-1-ylphenyl)acetamide is O=C(Cc1ccccc1)Nc1ccccc1N1CCCC1.
What is the InChIKey of 2-phenyl-N-(2-pyrrolidin-1-ylphenyl)acetamide?
The InChIKey is LVPBIJNAMHEKDK-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H20N2O/c21-18(14-15-8-2-1-3-9-15)19-16-10-4-5-11-17(16)20-12-6-7-13-20/h1-5,8-11H,6-7,12-14H2,(H,19,21).
What are the key properties of 2-phenyl-N-(2-pyrrolidin-1-ylphenyl)acetamide?
2-phenyl-N-(2-pyrrolidin-1-ylphenyl)acetamide has a molecular weight of 280.37 g/mol, XLogP of 3.47, 4 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-phenyl-N-(2-pyrrolidin-1-ylphenyl)acetamide is sourced from PubChem (CID 890442), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).