2-(4-chlorophenoxy)-N-phenylpropanamide

C15H14ClNO2 — CID 4943865

IUPAC2-(4-chlorophenoxy)-N-phenylpropanamide
SMILESCC(Oc1ccc(Cl)cc1)C(=O)Nc1ccccc1
InChIInChI=1S/C15H14ClNO2/c1-11(19-14-9-7-12(16)8-10-14)15(18)17-13-5-3-2-4-6-13/h2-11H,1H3,(H,17,18)
InChIKeyWQDQVPJNEWENQF-UHFFFAOYSA-N
MW275.74 g/mol
LogP3.75
Rot. Bonds4

About 2-(4-chlorophenoxy)-N-phenylpropanamide

2-(4-chlorophenoxy)-N-phenylpropanamide (PubChem CID 4943865) has the molecular formula C15H14ClNO2 and a molecular weight of 275.74 g/mol. Its IUPAC name is 2-(4-chlorophenoxy)-N-phenylpropanamide.

Molecular Properties

Compound Name2-(4-chlorophenoxy)-N-phenylpropanamide
PubChem CID4943865
Molecular FormulaC15H14ClNO2
Molecular Weight275.74 g/mol
Exact Mass275.07
IUPAC Name2-(4-chlorophenoxy)-N-phenylpropanamide
SMILESCC(Oc1ccc(Cl)cc1)C(=O)Nc1ccccc1
InChIInChI=1S/C15H14ClNO2/c1-11(19-14-9-7-12(16)8-10-14)15(18)17-13-5-3-2-4-6-13/h2-11H,1H3,(H,17,18)
InChIKeyWQDQVPJNEWENQF-UHFFFAOYSA-N
XLogP3.75
TPSA38.33 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms19
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500275.74
LogP ≤ 53.75
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 2-(4-chlorophenoxy)-N-phenylpropanamide?
The IUPAC name of 2-(4-chlorophenoxy)-N-phenylpropanamide (CID 4943865) is 2-(4-chlorophenoxy)-N-phenylpropanamide.
What is the SMILES notation for 2-(4-chlorophenoxy)-N-phenylpropanamide?
The canonical SMILES for 2-(4-chlorophenoxy)-N-phenylpropanamide is CC(Oc1ccc(Cl)cc1)C(=O)Nc1ccccc1.
What is the InChIKey of 2-(4-chlorophenoxy)-N-phenylpropanamide?
The InChIKey is WQDQVPJNEWENQF-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H14ClNO2/c1-11(19-14-9-7-12(16)8-10-14)15(18)17-13-5-3-2-4-6-13/h2-11H,1H3,(H,17,18).
What are the key properties of 2-(4-chlorophenoxy)-N-phenylpropanamide?
2-(4-chlorophenoxy)-N-phenylpropanamide has a molecular weight of 275.74 g/mol, XLogP of 3.75, 4 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(4-chlorophenoxy)-N-phenylpropanamide is sourced from PubChem (CID 4943865), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).