2-(4-chlorophenoxy)-N-(2-piperidin-1-ylethyl)acetamide

C15H21ClN2O2 — CID 2145527

IUPAC2-(4-chlorophenoxy)-N-(2-piperidin-1-ylethyl)acetamide
SMILESO=C(COc1ccc(Cl)cc1)NCCN1CCCCC1
InChIInChI=1S/C15H21ClN2O2/c16-13-4-6-14(7-5-13)20-12-15(19)17-8-11-18-9-2-1-3-10-18/h4-7H,1-3,8-12H2,(H,17,19)
InChIKeyXOLGYMPJZVKWBT-UHFFFAOYSA-N
MW296.80 g/mol
LogP2.32
Rot. Bonds6

About 2-(4-chlorophenoxy)-N-(2-piperidin-1-ylethyl)acetamide

2-(4-chlorophenoxy)-N-(2-piperidin-1-ylethyl)acetamide (PubChem CID 2145527) has the molecular formula C15H21ClN2O2 and a molecular weight of 296.80 g/mol. Its IUPAC name is 2-(4-chlorophenoxy)-N-(2-piperidin-1-ylethyl)acetamide.

Molecular Properties

Compound Name2-(4-chlorophenoxy)-N-(2-piperidin-1-ylethyl)acetamide
PubChem CID2145527
Molecular FormulaC15H21ClN2O2
Molecular Weight296.80 g/mol
Exact Mass296.13
IUPAC Name2-(4-chlorophenoxy)-N-(2-piperidin-1-ylethyl)acetamide
SMILESO=C(COc1ccc(Cl)cc1)NCCN1CCCCC1
InChIInChI=1S/C15H21ClN2O2/c16-13-4-6-14(7-5-13)20-12-15(19)17-8-11-18-9-2-1-3-10-18/h4-7H,1-3,8-12H2,(H,17,19)
InChIKeyXOLGYMPJZVKWBT-UHFFFAOYSA-N
XLogP2.32
TPSA41.57 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds6
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500296.80
LogP ≤ 52.32
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 2-(4-chlorophenoxy)-N-(2-piperidin-1-ylethyl)acetamide?
The IUPAC name of 2-(4-chlorophenoxy)-N-(2-piperidin-1-ylethyl)acetamide (CID 2145527) is 2-(4-chlorophenoxy)-N-(2-piperidin-1-ylethyl)acetamide.
What is the SMILES notation for 2-(4-chlorophenoxy)-N-(2-piperidin-1-ylethyl)acetamide?
The canonical SMILES for 2-(4-chlorophenoxy)-N-(2-piperidin-1-ylethyl)acetamide is O=C(COc1ccc(Cl)cc1)NCCN1CCCCC1.
What is the InChIKey of 2-(4-chlorophenoxy)-N-(2-piperidin-1-ylethyl)acetamide?
The InChIKey is XOLGYMPJZVKWBT-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H21ClN2O2/c16-13-4-6-14(7-5-13)20-12-15(19)17-8-11-18-9-2-1-3-10-18/h4-7H,1-3,8-12H2,(H,17,19).
What are the key properties of 2-(4-chlorophenoxy)-N-(2-piperidin-1-ylethyl)acetamide?
2-(4-chlorophenoxy)-N-(2-piperidin-1-ylethyl)acetamide has a molecular weight of 296.80 g/mol, XLogP of 2.32, 6 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(4-chlorophenoxy)-N-(2-piperidin-1-ylethyl)acetamide is sourced from PubChem (CID 2145527), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).