2-[(2-fluorophenyl)methoxy]-N-(2-methyl-4-oxopentan-3-yl)acetamide

C15H20FNO3 — CID 63935331

IUPAC2-[(2-fluorophenyl)methoxy]-N-(2-methyl-4-oxopentan-3-yl)acetamide
SMILESCC(=O)C(NC(=O)COCc1ccccc1F)C(C)C
InChIInChI=1S/C15H20FNO3/c1-10(2)15(11(3)18)17-14(19)9-20-8-12-6-4-5-7-13(12)16/h4-7,10,15H,8-9H2,1-3H3,(H,17,19)
InChIKeyMTMFKNIWDNMFBV-UHFFFAOYSA-N
MW281.33 g/mol
LogP2.07
Rot. Bonds7

About 2-[(2-fluorophenyl)methoxy]-N-(2-methyl-4-oxopentan-3-yl)acetamide

2-[(2-fluorophenyl)methoxy]-N-(2-methyl-4-oxopentan-3-yl)acetamide (PubChem CID 63935331) has the molecular formula C15H20FNO3 and a molecular weight of 281.33 g/mol. Its IUPAC name is 2-[(2-fluorophenyl)methoxy]-N-(2-methyl-4-oxopentan-3-yl)acetamide.

Molecular Properties

Compound Name2-[(2-fluorophenyl)methoxy]-N-(2-methyl-4-oxopentan-3-yl)acetamide
PubChem CID63935331
Molecular FormulaC15H20FNO3
Molecular Weight281.33 g/mol
Exact Mass281.14
IUPAC Name2-[(2-fluorophenyl)methoxy]-N-(2-methyl-4-oxopentan-3-yl)acetamide
SMILESCC(=O)C(NC(=O)COCc1ccccc1F)C(C)C
InChIInChI=1S/C15H20FNO3/c1-10(2)15(11(3)18)17-14(19)9-20-8-12-6-4-5-7-13(12)16/h4-7,10,15H,8-9H2,1-3H3,(H,17,19)
InChIKeyMTMFKNIWDNMFBV-UHFFFAOYSA-N
XLogP2.07
TPSA55.40 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds7
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500281.33
LogP ≤ 52.07
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

2-(2-cyano-3-fluorophenoxy)-N-(2-methyl-4-oxopentan-3-yl)acetamide
CID 62032180
N-(4-aminophenyl)-2-[(2-fluorophenyl)methoxy]acetamide
CID 63933863
(2S)-2-acetamido-N-[(2-fluorophenyl)methyl]-N,3-dimethylbutanamide
CID 31138547
2-(2-fluorophenyl)-N-(3-methylbutan-2-yl)acetamide
CID 78799919
2-(3-methylbutoxy)-N-(2-methyl-4-oxopentan-3-yl)acetamide
CID 43793356
2-[(2-chlorophenyl)methoxy]-N-[(1R)-1-(4-fluorophenyl)ethyl]acetamide
CID 51958272
2-[2-[(2-methyl-4-oxopentan-3-yl)amino]-2-oxoethoxy]benzamide
CID 43426354
1-fluoro-2-[(2-fluorophenyl)methoxymethyl]benzene
CID 67509440
(2R)-2-[[(2-fluorophenyl)methyl-methylcarbamoyl]amino]-3-methylbutanoic acid
CID 79010281
1-(4-fluorophenyl)-2-[(2-fluorophenyl)methoxy]ethanone
CID 63936750
2-(5-bromo-2,3-difluorophenoxy)-N-(2-methyl-4-oxopentan-3-yl)acetamide
CID 107100430
methyl (2S)-2-[[2-[(2-chlorophenyl)methoxy]acetyl]amino]propanoate
CID 87040393

Frequently Asked Questions

What is the IUPAC name of 2-[(2-fluorophenyl)methoxy]-N-(2-methyl-4-oxopentan-3-yl)acetamide?
The IUPAC name of 2-[(2-fluorophenyl)methoxy]-N-(2-methyl-4-oxopentan-3-yl)acetamide (CID 63935331) is 2-[(2-fluorophenyl)methoxy]-N-(2-methyl-4-oxopentan-3-yl)acetamide.
What is the SMILES notation for 2-[(2-fluorophenyl)methoxy]-N-(2-methyl-4-oxopentan-3-yl)acetamide?
The canonical SMILES for 2-[(2-fluorophenyl)methoxy]-N-(2-methyl-4-oxopentan-3-yl)acetamide is CC(=O)C(NC(=O)COCc1ccccc1F)C(C)C.
What is the InChIKey of 2-[(2-fluorophenyl)methoxy]-N-(2-methyl-4-oxopentan-3-yl)acetamide?
The InChIKey is MTMFKNIWDNMFBV-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H20FNO3/c1-10(2)15(11(3)18)17-14(19)9-20-8-12-6-4-5-7-13(12)16/h4-7,10,15H,8-9H2,1-3H3,(H,17,19).
What are the key properties of 2-[(2-fluorophenyl)methoxy]-N-(2-methyl-4-oxopentan-3-yl)acetamide?
2-[(2-fluorophenyl)methoxy]-N-(2-methyl-4-oxopentan-3-yl)acetamide has a molecular weight of 281.33 g/mol, XLogP of 2.07, 7 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[(2-fluorophenyl)methoxy]-N-(2-methyl-4-oxopentan-3-yl)acetamide is sourced from PubChem (CID 63935331), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).