2-(2-methoxyphenoxy)-N-(4-pyrrolidin-1-ylphenyl)acetamide

C19H22N2O3 — CID 9078575

IUPAC2-(2-methoxyphenoxy)-N-(4-pyrrolidin-1-ylphenyl)acetamide
SMILESCOc1ccccc1OCC(=O)Nc1ccc(N2CCCC2)cc1
InChIInChI=1S/C19H22N2O3/c1-23-17-6-2-3-7-18(17)24-14-19(22)20-15-8-10-16(11-9-15)21-12-4-5-13-21/h2-3,6-11H,4-5,12-14H2,1H3,(H,20,22)
InChIKeyZDNAVPUYCMHZQG-UHFFFAOYSA-N
MW326.40 g/mol
LogP3.31
Rot. Bonds6

About 2-(2-methoxyphenoxy)-N-(4-pyrrolidin-1-ylphenyl)acetamide

2-(2-methoxyphenoxy)-N-(4-pyrrolidin-1-ylphenyl)acetamide (PubChem CID 9078575) has the molecular formula C19H22N2O3 and a molecular weight of 326.40 g/mol. Its IUPAC name is 2-(2-methoxyphenoxy)-N-(4-pyrrolidin-1-ylphenyl)acetamide.

Molecular Properties

Compound Name2-(2-methoxyphenoxy)-N-(4-pyrrolidin-1-ylphenyl)acetamide
PubChem CID9078575
Molecular FormulaC19H22N2O3
Molecular Weight326.40 g/mol
Exact Mass326.16
IUPAC Name2-(2-methoxyphenoxy)-N-(4-pyrrolidin-1-ylphenyl)acetamide
SMILESCOc1ccccc1OCC(=O)Nc1ccc(N2CCCC2)cc1
InChIInChI=1S/C19H22N2O3/c1-23-17-6-2-3-7-18(17)24-14-19(22)20-15-8-10-16(11-9-15)21-12-4-5-13-21/h2-3,6-11H,4-5,12-14H2,1H3,(H,20,22)
InChIKeyZDNAVPUYCMHZQG-UHFFFAOYSA-N
XLogP3.31
TPSA50.80 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds6
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500326.40
LogP ≤ 53.31
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'anil_di_alk_A(478)', 'substructure': 'N/A'}

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Related Compounds

2-(2-methoxyphenoxy)-N-[4-(3-methoxypiperidin-1-yl)phenyl]acetamide
CID 121141457
N-[4-(azepan-1-yl)phenyl]-2-(2-chlorophenoxy)acetamide
CID 7582236
2-(2-chlorophenoxy)-N-(4-piperidin-1-ylphenyl)acetamide
CID 7922500
2-(2,6-dimethoxy-4-methylphenoxy)-N-(4-piperidin-1-ylphenyl)acetamide
CID 7550487
2-(4-formyl-2-methoxyphenoxy)-N-(4-piperidin-1-ylphenyl)acetamide
CID 26654844
N-[4-(azepan-1-yl)phenyl]-2-(2-formylphenoxy)acetamide
CID 9009767
N-(2-fluoro-5-piperidin-1-ylphenyl)-2-(2-methoxyphenoxy)acetamide
CID 110362257
2-(2,3-dimethoxyphenoxy)-N-[4-(4-methylpiperazin-1-yl)phenyl]acetamide
CID 112978484
N-[2-[2-oxo-2-(4-pyrrolidin-1-ylanilino)ethoxy]phenyl]benzamide
CID 67124692
2-(2-methoxyphenoxy)-N-(4-methylphenyl)acetamide
CID 675575
3-(2-methoxyanilino)-N-(4-pyrrolidin-1-ylphenyl)propanamide
CID 109039433
2-(2-methoxyphenoxy)-1-[4-(4-pyrrolidin-1-ylphenyl)piperazin-1-yl]ethanone
CID 113078931

Frequently Asked Questions

What is the IUPAC name of 2-(2-methoxyphenoxy)-N-(4-pyrrolidin-1-ylphenyl)acetamide?
The IUPAC name of 2-(2-methoxyphenoxy)-N-(4-pyrrolidin-1-ylphenyl)acetamide (CID 9078575) is 2-(2-methoxyphenoxy)-N-(4-pyrrolidin-1-ylphenyl)acetamide.
What is the SMILES notation for 2-(2-methoxyphenoxy)-N-(4-pyrrolidin-1-ylphenyl)acetamide?
The canonical SMILES for 2-(2-methoxyphenoxy)-N-(4-pyrrolidin-1-ylphenyl)acetamide is COc1ccccc1OCC(=O)Nc1ccc(N2CCCC2)cc1.
What is the InChIKey of 2-(2-methoxyphenoxy)-N-(4-pyrrolidin-1-ylphenyl)acetamide?
The InChIKey is ZDNAVPUYCMHZQG-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H22N2O3/c1-23-17-6-2-3-7-18(17)24-14-19(22)20-15-8-10-16(11-9-15)21-12-4-5-13-21/h2-3,6-11H,4-5,12-14H2,1H3,(H,20,22).
What are the key properties of 2-(2-methoxyphenoxy)-N-(4-pyrrolidin-1-ylphenyl)acetamide?
2-(2-methoxyphenoxy)-N-(4-pyrrolidin-1-ylphenyl)acetamide has a molecular weight of 326.40 g/mol, XLogP of 3.31, 6 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(2-methoxyphenoxy)-N-(4-pyrrolidin-1-ylphenyl)acetamide is sourced from PubChem (CID 9078575), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).