2-(3-methoxyphenyl)-N-(2-pyrrolidin-1-ylphenyl)acetamide

C19H22N2O2 — CID 18190094

IUPAC2-(3-methoxyphenyl)-N-(2-pyrrolidin-1-ylphenyl)acetamide
SMILESCOc1cccc(CC(=O)Nc2ccccc2N2CCCC2)c1
InChIInChI=1S/C19H22N2O2/c1-23-16-8-6-7-15(13-16)14-19(22)20-17-9-2-3-10-18(17)21-11-4-5-12-21/h2-3,6-10,13H,4-5,11-12,14H2,1H3,(H,20,22)
InChIKeyJSCOQLMZWXEAQV-UHFFFAOYSA-N
MW310.40 g/mol
LogP3.48
Rot. Bonds5

About 2-(3-methoxyphenyl)-N-(2-pyrrolidin-1-ylphenyl)acetamide

2-(3-methoxyphenyl)-N-(2-pyrrolidin-1-ylphenyl)acetamide (PubChem CID 18190094) has the molecular formula C19H22N2O2 and a molecular weight of 310.40 g/mol. Its IUPAC name is 2-(3-methoxyphenyl)-N-(2-pyrrolidin-1-ylphenyl)acetamide.

Molecular Properties

Compound Name2-(3-methoxyphenyl)-N-(2-pyrrolidin-1-ylphenyl)acetamide
PubChem CID18190094
Molecular FormulaC19H22N2O2
Molecular Weight310.40 g/mol
Exact Mass310.17
IUPAC Name2-(3-methoxyphenyl)-N-(2-pyrrolidin-1-ylphenyl)acetamide
SMILESCOc1cccc(CC(=O)Nc2ccccc2N2CCCC2)c1
InChIInChI=1S/C19H22N2O2/c1-23-16-8-6-7-15(13-16)14-19(22)20-17-9-2-3-10-18(17)21-11-4-5-12-21/h2-3,6-10,13H,4-5,11-12,14H2,1H3,(H,20,22)
InChIKeyJSCOQLMZWXEAQV-UHFFFAOYSA-N
XLogP3.48
TPSA41.57 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500310.40
LogP ≤ 53.48
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 2-(3-methoxyphenyl)-N-(2-pyrrolidin-1-ylphenyl)acetamide?
The IUPAC name of 2-(3-methoxyphenyl)-N-(2-pyrrolidin-1-ylphenyl)acetamide (CID 18190094) is 2-(3-methoxyphenyl)-N-(2-pyrrolidin-1-ylphenyl)acetamide.
What is the SMILES notation for 2-(3-methoxyphenyl)-N-(2-pyrrolidin-1-ylphenyl)acetamide?
The canonical SMILES for 2-(3-methoxyphenyl)-N-(2-pyrrolidin-1-ylphenyl)acetamide is COc1cccc(CC(=O)Nc2ccccc2N2CCCC2)c1.
What is the InChIKey of 2-(3-methoxyphenyl)-N-(2-pyrrolidin-1-ylphenyl)acetamide?
The InChIKey is JSCOQLMZWXEAQV-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H22N2O2/c1-23-16-8-6-7-15(13-16)14-19(22)20-17-9-2-3-10-18(17)21-11-4-5-12-21/h2-3,6-10,13H,4-5,11-12,14H2,1H3,(H,20,22).
What are the key properties of 2-(3-methoxyphenyl)-N-(2-pyrrolidin-1-ylphenyl)acetamide?
2-(3-methoxyphenyl)-N-(2-pyrrolidin-1-ylphenyl)acetamide has a molecular weight of 310.40 g/mol, XLogP of 3.48, 5 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(3-methoxyphenyl)-N-(2-pyrrolidin-1-ylphenyl)acetamide is sourced from PubChem (CID 18190094), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).