2-(3-chlorophenyl)-N-[(5-fluoro-2-methoxyphenyl)methyl]acetamide

C16H15ClFNO2 — CID 110780207

IUPAC2-(3-chlorophenyl)-N-[(5-fluoro-2-methoxyphenyl)methyl]acetamide
SMILESCOc1ccc(F)cc1CNC(=O)Cc1cccc(Cl)c1
InChIInChI=1S/C16H15ClFNO2/c1-21-15-6-5-14(18)9-12(15)10-19-16(20)8-11-3-2-4-13(17)7-11/h2-7,9H,8,10H2,1H3,(H,19,20)
InChIKeyIPTWXSDQFZODMW-UHFFFAOYSA-N
MW307.75 g/mol
LogP3.35
Rot. Bonds5

About 2-(3-chlorophenyl)-N-[(5-fluoro-2-methoxyphenyl)methyl]acetamide

2-(3-chlorophenyl)-N-[(5-fluoro-2-methoxyphenyl)methyl]acetamide (PubChem CID 110780207) has the molecular formula C16H15ClFNO2 and a molecular weight of 307.75 g/mol. Its IUPAC name is 2-(3-chlorophenyl)-N-[(5-fluoro-2-methoxyphenyl)methyl]acetamide.

Molecular Properties

Compound Name2-(3-chlorophenyl)-N-[(5-fluoro-2-methoxyphenyl)methyl]acetamide
PubChem CID110780207
Molecular FormulaC16H15ClFNO2
Molecular Weight307.75 g/mol
Exact Mass307.08
IUPAC Name2-(3-chlorophenyl)-N-[(5-fluoro-2-methoxyphenyl)methyl]acetamide
SMILESCOc1ccc(F)cc1CNC(=O)Cc1cccc(Cl)c1
InChIInChI=1S/C16H15ClFNO2/c1-21-15-6-5-14(18)9-12(15)10-19-16(20)8-11-3-2-4-13(17)7-11/h2-7,9H,8,10H2,1H3,(H,19,20)
InChIKeyIPTWXSDQFZODMW-UHFFFAOYSA-N
XLogP3.35
TPSA38.33 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds5
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500307.75
LogP ≤ 53.35
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

2-(3-chlorophenyl)-N-[(2,5-dimethoxyphenyl)methyl]acetamide
CID 110779915
N-[(5-fluoro-2-methoxyphenyl)methyl]-2-(3-methylphenyl)acetamide
CID 110780202
N-[(5-fluoro-2-methoxyphenyl)methyl]-2-(2-methoxyphenyl)acetamide
CID 110780208
N-[(3-chlorophenyl)methyl]-2-(3,4-dimethoxyphenyl)acetamide
CID 710725
N-[(3-amino-4-methoxyphenyl)methyl]-2-(3-chlorophenyl)acetamide
CID 62503557
3-chloro-N-[(5-fluoro-2-methoxyphenyl)methyl]propanamide
CID 115162483
2-amino-N-[(5-fluoro-2-methoxyphenyl)methyl]acetamide
CID 82126824
1-(5-chloro-2-methoxyphenyl)-3-(3-chlorophenyl)propan-2-one
CID 62620945
N-[(3-fluoro-4-methoxyphenyl)methyl]-2-(3-fluorophenyl)acetamide
CID 110780014
2-(5-fluoro-2-methoxyphenyl)-N-(2-phenylethyl)acetamide
CID 110767149
2-(3-chloro-4-methoxyphenyl)-N-[(2-methoxyphenyl)methyl]acetamide
CID 110767041
2-(2-bromo-4,5-dimethoxyphenyl)-N-[(3-chlorophenyl)methyl]acetamide
CID 9209889

Frequently Asked Questions

What is the IUPAC name of 2-(3-chlorophenyl)-N-[(5-fluoro-2-methoxyphenyl)methyl]acetamide?
The IUPAC name of 2-(3-chlorophenyl)-N-[(5-fluoro-2-methoxyphenyl)methyl]acetamide (CID 110780207) is 2-(3-chlorophenyl)-N-[(5-fluoro-2-methoxyphenyl)methyl]acetamide.
What is the SMILES notation for 2-(3-chlorophenyl)-N-[(5-fluoro-2-methoxyphenyl)methyl]acetamide?
The canonical SMILES for 2-(3-chlorophenyl)-N-[(5-fluoro-2-methoxyphenyl)methyl]acetamide is COc1ccc(F)cc1CNC(=O)Cc1cccc(Cl)c1.
What is the InChIKey of 2-(3-chlorophenyl)-N-[(5-fluoro-2-methoxyphenyl)methyl]acetamide?
The InChIKey is IPTWXSDQFZODMW-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H15ClFNO2/c1-21-15-6-5-14(18)9-12(15)10-19-16(20)8-11-3-2-4-13(17)7-11/h2-7,9H,8,10H2,1H3,(H,19,20).
What are the key properties of 2-(3-chlorophenyl)-N-[(5-fluoro-2-methoxyphenyl)methyl]acetamide?
2-(3-chlorophenyl)-N-[(5-fluoro-2-methoxyphenyl)methyl]acetamide has a molecular weight of 307.75 g/mol, XLogP of 3.35, 5 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(3-chlorophenyl)-N-[(5-fluoro-2-methoxyphenyl)methyl]acetamide is sourced from PubChem (CID 110780207), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).