2-(2-fluorophenoxy)-N-[(4-methoxy-2,3-dimethylphenyl)methyl]acetamide

C18H20FNO3 — CID 110783085

IUPAC2-(2-fluorophenoxy)-N-[(4-methoxy-2,3-dimethylphenyl)methyl]acetamide
SMILESCOc1ccc(CNC(=O)COc2ccccc2F)c(C)c1C
InChIInChI=1S/C18H20FNO3/c1-12-13(2)16(22-3)9-8-14(12)10-20-18(21)11-23-17-7-5-4-6-15(17)19/h4-9H,10-11H2,1-3H3,(H,20,21)
InChIKeyBJMMMJNKNDSXJI-UHFFFAOYSA-N
MW317.36 g/mol
LogP3.15
Rot. Bonds6

About 2-(2-fluorophenoxy)-N-[(4-methoxy-2,3-dimethylphenyl)methyl]acetamide

2-(2-fluorophenoxy)-N-[(4-methoxy-2,3-dimethylphenyl)methyl]acetamide (PubChem CID 110783085) has the molecular formula C18H20FNO3 and a molecular weight of 317.36 g/mol. Its IUPAC name is 2-(2-fluorophenoxy)-N-[(4-methoxy-2,3-dimethylphenyl)methyl]acetamide.

Molecular Properties

Compound Name2-(2-fluorophenoxy)-N-[(4-methoxy-2,3-dimethylphenyl)methyl]acetamide
PubChem CID110783085
Molecular FormulaC18H20FNO3
Molecular Weight317.36 g/mol
Exact Mass317.14
IUPAC Name2-(2-fluorophenoxy)-N-[(4-methoxy-2,3-dimethylphenyl)methyl]acetamide
SMILESCOc1ccc(CNC(=O)COc2ccccc2F)c(C)c1C
InChIInChI=1S/C18H20FNO3/c1-12-13(2)16(22-3)9-8-14(12)10-20-18(21)11-23-17-7-5-4-6-15(17)19/h4-9H,10-11H2,1-3H3,(H,20,21)
InChIKeyBJMMMJNKNDSXJI-UHFFFAOYSA-N
XLogP3.15
TPSA47.56 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds6
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500317.36
LogP ≤ 53.15
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

[2-[(2-methoxyphenyl)methylamino]-2-oxoethyl] 2-(2-fluorophenoxy)acetate
CID 8002848
2-(2-methylphenoxy)-N-[(2,3,4-trimethoxyphenyl)methyl]acetamide
CID 94043014
2-(2-fluorophenoxy)-N-[(4-fluorophenyl)methyl]acetamide
CID 7700855
3-[(4-methoxy-2,3-dimethylphenyl)methylamino]-3-oxopropanoic acid
CID 115163405
methyl 4-[[[2-(2-fluorophenoxy)acetyl]amino]methyl]benzoate
CID 7815449
2-(2-fluorophenoxy)-N-(quinolin-4-ylmethyl)acetamide
CID 71979329
N-[(3-fluoro-4-methylphenyl)methyl]-2-(2-fluorophenoxy)acetamide
CID 34315448
2-(2-ethylphenoxy)-N-[(2-methoxyphenyl)methyl]acetamide
CID 2709267
2-(2-fluorophenoxy)-N-[(6-methoxy-3-pyridinyl)methyl]acetamide
CID 51306226
N-[3-(2-fluorophenoxy)propyl]-2-(2-methoxy-4-methylphenoxy)acetamide
CID 18120320
N-[(6,7-dimethyl-2-oxo-1H-quinolin-3-yl)methyl]-2-(2-fluorophenoxy)acetamide
CID 110662696
N-[(2-methoxyphenyl)methyl]-2-(2,4,5-trimethylphenoxy)acetamide
CID 112978023

Frequently Asked Questions

What is the IUPAC name of 2-(2-fluorophenoxy)-N-[(4-methoxy-2,3-dimethylphenyl)methyl]acetamide?
The IUPAC name of 2-(2-fluorophenoxy)-N-[(4-methoxy-2,3-dimethylphenyl)methyl]acetamide (CID 110783085) is 2-(2-fluorophenoxy)-N-[(4-methoxy-2,3-dimethylphenyl)methyl]acetamide.
What is the SMILES notation for 2-(2-fluorophenoxy)-N-[(4-methoxy-2,3-dimethylphenyl)methyl]acetamide?
The canonical SMILES for 2-(2-fluorophenoxy)-N-[(4-methoxy-2,3-dimethylphenyl)methyl]acetamide is COc1ccc(CNC(=O)COc2ccccc2F)c(C)c1C.
What is the InChIKey of 2-(2-fluorophenoxy)-N-[(4-methoxy-2,3-dimethylphenyl)methyl]acetamide?
The InChIKey is BJMMMJNKNDSXJI-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H20FNO3/c1-12-13(2)16(22-3)9-8-14(12)10-20-18(21)11-23-17-7-5-4-6-15(17)19/h4-9H,10-11H2,1-3H3,(H,20,21).
What are the key properties of 2-(2-fluorophenoxy)-N-[(4-methoxy-2,3-dimethylphenyl)methyl]acetamide?
2-(2-fluorophenoxy)-N-[(4-methoxy-2,3-dimethylphenyl)methyl]acetamide has a molecular weight of 317.36 g/mol, XLogP of 3.15, 6 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(2-fluorophenoxy)-N-[(4-methoxy-2,3-dimethylphenyl)methyl]acetamide is sourced from PubChem (CID 110783085), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).