2-(3-chlorophenoxy)-N-(2-piperidin-1-ylphenyl)acetamide

C19H21ClN2O2 — CID 24980969

IUPAC2-(3-chlorophenoxy)-N-(2-piperidin-1-ylphenyl)acetamide
SMILESO=C(COc1cccc(Cl)c1)Nc1ccccc1N1CCCCC1
InChIInChI=1S/C19H21ClN2O2/c20-15-7-6-8-16(13-15)24-14-19(23)21-17-9-2-3-10-18(17)22-11-4-1-5-12-22/h2-3,6-10,13H,1,4-5,11-12,14H2,(H,21,23)
InChIKeyDEYSRTKGOMNOET-UHFFFAOYSA-N
MW344.84 g/mol
LogP4.35
Rot. Bonds5

About 2-(3-chlorophenoxy)-N-(2-piperidin-1-ylphenyl)acetamide

2-(3-chlorophenoxy)-N-(2-piperidin-1-ylphenyl)acetamide (PubChem CID 24980969) has the molecular formula C19H21ClN2O2 and a molecular weight of 344.84 g/mol. Its IUPAC name is 2-(3-chlorophenoxy)-N-(2-piperidin-1-ylphenyl)acetamide.

Molecular Properties

Compound Name2-(3-chlorophenoxy)-N-(2-piperidin-1-ylphenyl)acetamide
PubChem CID24980969
Molecular FormulaC19H21ClN2O2
Molecular Weight344.84 g/mol
Exact Mass344.13
IUPAC Name2-(3-chlorophenoxy)-N-(2-piperidin-1-ylphenyl)acetamide
SMILESO=C(COc1cccc(Cl)c1)Nc1ccccc1N1CCCCC1
InChIInChI=1S/C19H21ClN2O2/c20-15-7-6-8-16(13-15)24-14-19(23)21-17-9-2-3-10-18(17)22-11-4-1-5-12-22/h2-3,6-10,13H,1,4-5,11-12,14H2,(H,21,23)
InChIKeyDEYSRTKGOMNOET-UHFFFAOYSA-N
XLogP4.35
TPSA41.57 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500344.84
LogP ≤ 54.35
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 2-(3-chlorophenoxy)-N-(2-piperidin-1-ylphenyl)acetamide?
The IUPAC name of 2-(3-chlorophenoxy)-N-(2-piperidin-1-ylphenyl)acetamide (CID 24980969) is 2-(3-chlorophenoxy)-N-(2-piperidin-1-ylphenyl)acetamide.
What is the SMILES notation for 2-(3-chlorophenoxy)-N-(2-piperidin-1-ylphenyl)acetamide?
The canonical SMILES for 2-(3-chlorophenoxy)-N-(2-piperidin-1-ylphenyl)acetamide is O=C(COc1cccc(Cl)c1)Nc1ccccc1N1CCCCC1.
What is the InChIKey of 2-(3-chlorophenoxy)-N-(2-piperidin-1-ylphenyl)acetamide?
The InChIKey is DEYSRTKGOMNOET-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H21ClN2O2/c20-15-7-6-8-16(13-15)24-14-19(23)21-17-9-2-3-10-18(17)22-11-4-1-5-12-22/h2-3,6-10,13H,1,4-5,11-12,14H2,(H,21,23).
What are the key properties of 2-(3-chlorophenoxy)-N-(2-piperidin-1-ylphenyl)acetamide?
2-(3-chlorophenoxy)-N-(2-piperidin-1-ylphenyl)acetamide has a molecular weight of 344.84 g/mol, XLogP of 4.35, 5 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(3-chlorophenoxy)-N-(2-piperidin-1-ylphenyl)acetamide is sourced from PubChem (CID 24980969), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).