2-(2-fluorophenoxy)-N-(quinolin-4-ylmethyl)acetamide

C18H15FN2O2 — CID 71979329

IUPAC2-(2-fluorophenoxy)-N-(quinolin-4-ylmethyl)acetamide
SMILESO=C(COc1ccccc1F)NCc1ccnc2ccccc12
InChIInChI=1S/C18H15FN2O2/c19-15-6-2-4-8-17(15)23-12-18(22)21-11-13-9-10-20-16-7-3-1-5-14(13)16/h1-10H,11-12H2,(H,21,22)
InChIKeyFTRDAAYTOJQTQR-UHFFFAOYSA-N
MW310.33 g/mol
LogP3.07
Rot. Bonds5

About 2-(2-fluorophenoxy)-N-(quinolin-4-ylmethyl)acetamide

2-(2-fluorophenoxy)-N-(quinolin-4-ylmethyl)acetamide (PubChem CID 71979329) has the molecular formula C18H15FN2O2 and a molecular weight of 310.33 g/mol. Its IUPAC name is 2-(2-fluorophenoxy)-N-(quinolin-4-ylmethyl)acetamide.

Molecular Properties

Compound Name2-(2-fluorophenoxy)-N-(quinolin-4-ylmethyl)acetamide
PubChem CID71979329
Molecular FormulaC18H15FN2O2
Molecular Weight310.33 g/mol
Exact Mass310.11
IUPAC Name2-(2-fluorophenoxy)-N-(quinolin-4-ylmethyl)acetamide
SMILESO=C(COc1ccccc1F)NCc1ccnc2ccccc12
InChIInChI=1S/C18H15FN2O2/c19-15-6-2-4-8-17(15)23-12-18(22)21-11-13-9-10-20-16-7-3-1-5-14(13)16/h1-10H,11-12H2,(H,21,22)
InChIKeyFTRDAAYTOJQTQR-UHFFFAOYSA-N
XLogP3.07
TPSA51.22 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500310.33
LogP ≤ 53.07
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

2-(2-methoxyphenoxy)-N-(quinolin-4-ylmethyl)acetamide
CID 71979334
2-(2-cyanophenoxy)-N-(quinolin-4-ylmethyl)acetamide
CID 71979331
2-(2-fluorophenoxy)-N-[(4-fluorophenyl)methyl]acetamide
CID 7700855
2-(2-fluorophenoxy)-N-[(2-pyridin-4-yl-4-pyridinyl)methyl]acetamide
CID 121165301
2-(3-methylphenoxy)-N-(quinolin-4-ylmethyl)acetamide
CID 110734260
2-(2-fluorophenoxy)-N-[(4-methoxy-2,3-dimethylphenyl)methyl]acetamide
CID 110783085
N-[[2-(dimethylamino)pyrimidin-4-yl]methyl]-2-(2-fluorophenoxy)acetamide
CID 122354279
N-[[4-(benzimidazol-1-ylmethyl)phenyl]methyl]-2-(2-fluorophenoxy)acetamide
CID 49047342
2-(2-aminophenoxy)-N-[(2-fluorophenyl)methyl]acetamide
CID 16781117
methyl 4-[[[2-(2-fluorophenoxy)acetyl]amino]methyl]benzoate
CID 7815449
N-[(3-fluoro-4-methylphenyl)methyl]-2-(2-fluorophenoxy)acetamide
CID 34315448
2-(2-fluorophenoxy)-N-[(6-methoxy-3-pyridinyl)methyl]acetamide
CID 51306226

Frequently Asked Questions

What is the IUPAC name of 2-(2-fluorophenoxy)-N-(quinolin-4-ylmethyl)acetamide?
The IUPAC name of 2-(2-fluorophenoxy)-N-(quinolin-4-ylmethyl)acetamide (CID 71979329) is 2-(2-fluorophenoxy)-N-(quinolin-4-ylmethyl)acetamide.
What is the SMILES notation for 2-(2-fluorophenoxy)-N-(quinolin-4-ylmethyl)acetamide?
The canonical SMILES for 2-(2-fluorophenoxy)-N-(quinolin-4-ylmethyl)acetamide is O=C(COc1ccccc1F)NCc1ccnc2ccccc12.
What is the InChIKey of 2-(2-fluorophenoxy)-N-(quinolin-4-ylmethyl)acetamide?
The InChIKey is FTRDAAYTOJQTQR-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H15FN2O2/c19-15-6-2-4-8-17(15)23-12-18(22)21-11-13-9-10-20-16-7-3-1-5-14(13)16/h1-10H,11-12H2,(H,21,22).
What are the key properties of 2-(2-fluorophenoxy)-N-(quinolin-4-ylmethyl)acetamide?
2-(2-fluorophenoxy)-N-(quinolin-4-ylmethyl)acetamide has a molecular weight of 310.33 g/mol, XLogP of 3.07, 5 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(2-fluorophenoxy)-N-(quinolin-4-ylmethyl)acetamide is sourced from PubChem (CID 71979329), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).