2-(2-chlorophenoxy)-N-[2-(piperidine-1-carbonyl)phenyl]acetamide

C20H21ClN2O3 — CID 4936043

IUPAC2-(2-chlorophenoxy)-N-[2-(piperidine-1-carbonyl)phenyl]acetamide
SMILESO=C(COc1ccccc1Cl)Nc1ccccc1C(=O)N1CCCCC1
InChIInChI=1S/C20H21ClN2O3/c21-16-9-3-5-11-18(16)26-14-19(24)22-17-10-4-2-8-15(17)20(25)23-12-6-1-7-13-23/h2-5,8-11H,1,6-7,12-14H2,(H,22,24)
InChIKeySJYQGRHJRFYGHY-UHFFFAOYSA-N
MW372.85 g/mol
LogP3.98
Rot. Bonds5

About 2-(2-chlorophenoxy)-N-[2-(piperidine-1-carbonyl)phenyl]acetamide

2-(2-chlorophenoxy)-N-[2-(piperidine-1-carbonyl)phenyl]acetamide (PubChem CID 4936043) has the molecular formula C20H21ClN2O3 and a molecular weight of 372.85 g/mol. Its IUPAC name is 2-(2-chlorophenoxy)-N-[2-(piperidine-1-carbonyl)phenyl]acetamide.

Molecular Properties

Compound Name2-(2-chlorophenoxy)-N-[2-(piperidine-1-carbonyl)phenyl]acetamide
PubChem CID4936043
Molecular FormulaC20H21ClN2O3
Molecular Weight372.85 g/mol
Exact Mass372.12
IUPAC Name2-(2-chlorophenoxy)-N-[2-(piperidine-1-carbonyl)phenyl]acetamide
SMILESO=C(COc1ccccc1Cl)Nc1ccccc1C(=O)N1CCCCC1
InChIInChI=1S/C20H21ClN2O3/c21-16-9-3-5-11-18(16)26-14-19(24)22-17-10-4-2-8-15(17)20(25)23-12-6-1-7-13-23/h2-5,8-11H,1,6-7,12-14H2,(H,22,24)
InChIKeySJYQGRHJRFYGHY-UHFFFAOYSA-N
XLogP3.98
TPSA58.64 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms26
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500372.85
LogP ≤ 53.98
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 2-(2-chlorophenoxy)-N-[2-(piperidine-1-carbonyl)phenyl]acetamide?
The IUPAC name of 2-(2-chlorophenoxy)-N-[2-(piperidine-1-carbonyl)phenyl]acetamide (CID 4936043) is 2-(2-chlorophenoxy)-N-[2-(piperidine-1-carbonyl)phenyl]acetamide.
What is the SMILES notation for 2-(2-chlorophenoxy)-N-[2-(piperidine-1-carbonyl)phenyl]acetamide?
The canonical SMILES for 2-(2-chlorophenoxy)-N-[2-(piperidine-1-carbonyl)phenyl]acetamide is O=C(COc1ccccc1Cl)Nc1ccccc1C(=O)N1CCCCC1.
What is the InChIKey of 2-(2-chlorophenoxy)-N-[2-(piperidine-1-carbonyl)phenyl]acetamide?
The InChIKey is SJYQGRHJRFYGHY-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H21ClN2O3/c21-16-9-3-5-11-18(16)26-14-19(24)22-17-10-4-2-8-15(17)20(25)23-12-6-1-7-13-23/h2-5,8-11H,1,6-7,12-14H2,(H,22,24).
What are the key properties of 2-(2-chlorophenoxy)-N-[2-(piperidine-1-carbonyl)phenyl]acetamide?
2-(2-chlorophenoxy)-N-[2-(piperidine-1-carbonyl)phenyl]acetamide has a molecular weight of 372.85 g/mol, XLogP of 3.98, 5 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(2-chlorophenoxy)-N-[2-(piperidine-1-carbonyl)phenyl]acetamide is sourced from PubChem (CID 4936043), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).