N-(4-chlorophenyl)-2-(4-methoxyphenoxy)propanamide

C16H16ClNO3 — CID 2789590

IUPACN-(4-chlorophenyl)-2-(4-methoxyphenoxy)propanamide
SMILESCOc1ccc(OC(C)C(=O)Nc2ccc(Cl)cc2)cc1
InChIInChI=1S/C16H16ClNO3/c1-11(21-15-9-7-14(20-2)8-10-15)16(19)18-13-5-3-12(17)4-6-13/h3-11H,1-2H3,(H,18,19)
InChIKeyCCGSBWAENHMDIG-UHFFFAOYSA-N
MW305.76 g/mol
LogP3.75
Rot. Bonds5

About N-(4-chlorophenyl)-2-(4-methoxyphenoxy)propanamide

N-(4-chlorophenyl)-2-(4-methoxyphenoxy)propanamide (PubChem CID 2789590) has the molecular formula C16H16ClNO3 and a molecular weight of 305.76 g/mol. Its IUPAC name is N-(4-chlorophenyl)-2-(4-methoxyphenoxy)propanamide.

Molecular Properties

Compound NameN-(4-chlorophenyl)-2-(4-methoxyphenoxy)propanamide
PubChem CID2789590
Molecular FormulaC16H16ClNO3
Molecular Weight305.76 g/mol
Exact Mass305.08
IUPAC NameN-(4-chlorophenyl)-2-(4-methoxyphenoxy)propanamide
SMILESCOc1ccc(OC(C)C(=O)Nc2ccc(Cl)cc2)cc1
InChIInChI=1S/C16H16ClNO3/c1-11(21-15-9-7-14(20-2)8-10-15)16(19)18-13-5-3-12(17)4-6-13/h3-11H,1-2H3,(H,18,19)
InChIKeyCCGSBWAENHMDIG-UHFFFAOYSA-N
XLogP3.75
TPSA47.56 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500305.76
LogP ≤ 53.75
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

N-(4-acetamidophenyl)-2-(4-chlorophenoxy)propanamide
CID 4943851
N-[4-[2-(4-chlorophenoxy)propanoylamino]phenyl]-2-methylpropanamide
CID 17187935
2-(4-chlorophenoxy)-N-(4-methylphenyl)propanamide
CID 4943921
2-(4-methoxyphenoxy)-N-(4-propan-2-ylphenyl)propanamide
CID 2951611
N-(4-chlorophenyl)-2-(3-methoxyphenoxy)propanamide
CID 19203909
2-(4-chlorophenoxy)-N-phenylpropanamide
CID 4943865
2-(4-chlorophenoxy)-N-[4-[[4-[2-(4-chlorophenoxy)propanoylamino]phenyl]methyl]phenyl]propanamide
CID 4944300
N-(4-iodophenyl)-2-(4-methoxyphenoxy)propanamide
CID 2952531
(2S)-2-(4-bromophenoxy)-N-(4-methoxyphenyl)propanamide
CID 7899999
N-(4-bromophenyl)-2-(4-methoxyphenoxy)propanamide
CID 2789595
(2R)-2-(4-chlorophenoxy)-N-(3,4-dimethoxyphenyl)propanamide
CID 2088418
4-[[(2R)-2-(4-chlorophenoxy)propanoyl]amino]benzamide
CID 7816278

Frequently Asked Questions

What is the IUPAC name of N-(4-chlorophenyl)-2-(4-methoxyphenoxy)propanamide?
The IUPAC name of N-(4-chlorophenyl)-2-(4-methoxyphenoxy)propanamide (CID 2789590) is N-(4-chlorophenyl)-2-(4-methoxyphenoxy)propanamide.
What is the SMILES notation for N-(4-chlorophenyl)-2-(4-methoxyphenoxy)propanamide?
The canonical SMILES for N-(4-chlorophenyl)-2-(4-methoxyphenoxy)propanamide is COc1ccc(OC(C)C(=O)Nc2ccc(Cl)cc2)cc1.
What is the InChIKey of N-(4-chlorophenyl)-2-(4-methoxyphenoxy)propanamide?
The InChIKey is CCGSBWAENHMDIG-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H16ClNO3/c1-11(21-15-9-7-14(20-2)8-10-15)16(19)18-13-5-3-12(17)4-6-13/h3-11H,1-2H3,(H,18,19).
What are the key properties of N-(4-chlorophenyl)-2-(4-methoxyphenoxy)propanamide?
N-(4-chlorophenyl)-2-(4-methoxyphenoxy)propanamide has a molecular weight of 305.76 g/mol, XLogP of 3.75, 5 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-(4-chlorophenyl)-2-(4-methoxyphenoxy)propanamide is sourced from PubChem (CID 2789590), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).