N-[(4-chlorophenyl)methyl]-2-(4-methoxyphenoxy)acetamide

C16H16ClNO3 — CID 809048

IUPACN-[(4-chlorophenyl)methyl]-2-(4-methoxyphenoxy)acetamide
SMILESCOc1ccc(OCC(=O)NCc2ccc(Cl)cc2)cc1
InChIInChI=1S/C16H16ClNO3/c1-20-14-6-8-15(9-7-14)21-11-16(19)18-10-12-2-4-13(17)5-3-12/h2-9H,10-11H2,1H3,(H,18,19)
InChIKeyNASHCQWZDDQTGU-UHFFFAOYSA-N
MW305.76 g/mol
LogP3.04
Rot. Bonds6

About N-[(4-chlorophenyl)methyl]-2-(4-methoxyphenoxy)acetamide

N-[(4-chlorophenyl)methyl]-2-(4-methoxyphenoxy)acetamide (PubChem CID 809048) has the molecular formula C16H16ClNO3 and a molecular weight of 305.76 g/mol. Its IUPAC name is N-[(4-chlorophenyl)methyl]-2-(4-methoxyphenoxy)acetamide.

Molecular Properties

Compound NameN-[(4-chlorophenyl)methyl]-2-(4-methoxyphenoxy)acetamide
PubChem CID809048
Molecular FormulaC16H16ClNO3
Molecular Weight305.76 g/mol
Exact Mass305.08
IUPAC NameN-[(4-chlorophenyl)methyl]-2-(4-methoxyphenoxy)acetamide
SMILESCOc1ccc(OCC(=O)NCc2ccc(Cl)cc2)cc1
InChIInChI=1S/C16H16ClNO3/c1-20-14-6-8-15(9-7-14)21-11-16(19)18-10-12-2-4-13(17)5-3-12/h2-9H,10-11H2,1H3,(H,18,19)
InChIKeyNASHCQWZDDQTGU-UHFFFAOYSA-N
XLogP3.04
TPSA47.56 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds6
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500305.76
LogP ≤ 53.04
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

2-(4-chlorophenoxy)-N-[[4-(methylaminomethyl)phenyl]methyl]acetamide
CID 170046008
2-[[2-(4-chlorophenoxy)acetyl]amino]-N-[(4-chlorophenyl)methyl]acetamide
CID 110285271
N-[(4-methoxyphenyl)methyl]-2-(4-propan-2-ylphenoxy)acetamide
CID 1122194
4-[[[2-(4-chlorophenoxy)acetyl]amino]methyl]benzoic acid
CID 17171925
2-(4-chlorophenoxy)-N-[[4-(difluoromethoxy)phenyl]methyl]acetamide
CID 42007084
N-[(4-methoxyphenyl)methyl]-2-[[2-(4-methylphenoxy)acetyl]amino]acetamide
CID 48501757
N-[2-[(4-chlorophenyl)methylamino]-2-oxoethyl]-2-(4-methoxyphenyl)acetamide
CID 110285268
2-methoxy-N-[(4-methoxyphenyl)methyl]acetamide
CID 885776
2-(4-chlorophenoxy)-N-[[4-(dimethylsulfamoyl)phenyl]methyl]acetamide
CID 30125973
2-(6-bromonaphthalen-2-yl)oxy-N-[(4-chlorophenyl)methyl]acetamide
CID 7786789
[(2S)-1-[(4-methoxyphenyl)methylamino]-1-oxopropan-2-yl] 2-(4-chlorophenoxy)acetate
CID 7750595
N-(3-chlorophenyl)-4-[2-[(4-methoxyphenyl)methylamino]-2-oxoethoxy]benzamide
CID 162640903

Frequently Asked Questions

What is the IUPAC name of N-[(4-chlorophenyl)methyl]-2-(4-methoxyphenoxy)acetamide?
The IUPAC name of N-[(4-chlorophenyl)methyl]-2-(4-methoxyphenoxy)acetamide (CID 809048) is N-[(4-chlorophenyl)methyl]-2-(4-methoxyphenoxy)acetamide.
What is the SMILES notation for N-[(4-chlorophenyl)methyl]-2-(4-methoxyphenoxy)acetamide?
The canonical SMILES for N-[(4-chlorophenyl)methyl]-2-(4-methoxyphenoxy)acetamide is COc1ccc(OCC(=O)NCc2ccc(Cl)cc2)cc1.
What is the InChIKey of N-[(4-chlorophenyl)methyl]-2-(4-methoxyphenoxy)acetamide?
The InChIKey is NASHCQWZDDQTGU-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H16ClNO3/c1-20-14-6-8-15(9-7-14)21-11-16(19)18-10-12-2-4-13(17)5-3-12/h2-9H,10-11H2,1H3,(H,18,19).
What are the key properties of N-[(4-chlorophenyl)methyl]-2-(4-methoxyphenoxy)acetamide?
N-[(4-chlorophenyl)methyl]-2-(4-methoxyphenoxy)acetamide has a molecular weight of 305.76 g/mol, XLogP of 3.04, 6 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-[(4-chlorophenyl)methyl]-2-(4-methoxyphenoxy)acetamide is sourced from PubChem (CID 809048), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).