2-(2-fluorophenoxy)-N-[(2S)-1-(2-methylphenoxy)propan-2-yl]acetamide

C18H20FNO3 — CID 94623553

IUPAC2-(2-fluorophenoxy)-N-[(2S)-1-(2-methylphenoxy)propan-2-yl]acetamide
SMILESCc1ccccc1OC[C@H](C)NC(=O)COc1ccccc1F
InChIInChI=1S/C18H20FNO3/c1-13-7-3-5-9-16(13)22-11-14(2)20-18(21)12-23-17-10-6-4-8-15(17)19/h3-10,14H,11-12H2,1-2H3,(H,20,21)/t14-/m0/s1
InChIKeyMHNFQNFDOYNYFN-AWEZNQCLSA-N
MW317.36 g/mol
LogP3.10
Rot. Bonds7

About 2-(2-fluorophenoxy)-N-[(2S)-1-(2-methylphenoxy)propan-2-yl]acetamide

2-(2-fluorophenoxy)-N-[(2S)-1-(2-methylphenoxy)propan-2-yl]acetamide (PubChem CID 94623553) has the molecular formula C18H20FNO3 and a molecular weight of 317.36 g/mol. Its IUPAC name is 2-(2-fluorophenoxy)-N-[(2S)-1-(2-methylphenoxy)propan-2-yl]acetamide.

Molecular Properties

Compound Name2-(2-fluorophenoxy)-N-[(2S)-1-(2-methylphenoxy)propan-2-yl]acetamide
PubChem CID94623553
Molecular FormulaC18H20FNO3
Molecular Weight317.36 g/mol
Exact Mass317.14
IUPAC Name2-(2-fluorophenoxy)-N-[(2S)-1-(2-methylphenoxy)propan-2-yl]acetamide
SMILESCc1ccccc1OC[C@H](C)NC(=O)COc1ccccc1F
InChIInChI=1S/C18H20FNO3/c1-13-7-3-5-9-16(13)22-11-14(2)20-18(21)12-23-17-10-6-4-8-15(17)19/h3-10,14H,11-12H2,1-2H3,(H,20,21)/t14-/m0/s1
InChIKeyMHNFQNFDOYNYFN-AWEZNQCLSA-N
XLogP3.10
TPSA47.56 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds7
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500317.36
LogP ≤ 53.10
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

2-(2,3-dimethylphenoxy)-N-[1-(2-methylphenoxy)propan-2-yl]acetamide
CID 132651176
N-[1-(2-methylphenoxy)propan-2-yl]-2-(2,3,5-trimethylphenoxy)acetamide
CID 132652265
2-(3,5-dimethoxyphenoxy)-N-[1-(2-methylphenoxy)propan-2-yl]acetamide
CID 132654122
N-[(2S)-3-methylbutan-2-yl]-2-(2-methylphenoxy)acetamide
CID 94223613
N-[2-(2-fluorophenoxy)ethyl]-2-(2-methylphenoxy)acetamide
CID 18113601
N-[(2R)-1-(2-methylphenoxy)propan-2-yl]-2-(4-methylphenyl)acetamide
CID 94623535
2-(2-fluorophenoxy)-N-[1-(4-fluorophenyl)ethyl]acetamide
CID 16546160
N-[1-(2-methylphenoxy)propan-2-yl]-2-phenylsulfanylacetamide
CID 132650617
2-(2-chlorophenyl)-N-[1-(2-methylphenoxy)propan-2-yl]acetamide
CID 133166960
(2S)-2-[[2-(2-methylphenoxy)acetyl]amino]propanoate
CID 9157045
(2R)-2-[[2-(2-methylphenoxy)acetyl]amino]propanoate
CID 9157049
N-[(1R)-1-(2,4-dimethylphenyl)ethyl]-2-(2-fluorophenoxy)acetamide
CID 94843755

Frequently Asked Questions

What is the IUPAC name of 2-(2-fluorophenoxy)-N-[(2S)-1-(2-methylphenoxy)propan-2-yl]acetamide?
The IUPAC name of 2-(2-fluorophenoxy)-N-[(2S)-1-(2-methylphenoxy)propan-2-yl]acetamide (CID 94623553) is 2-(2-fluorophenoxy)-N-[(2S)-1-(2-methylphenoxy)propan-2-yl]acetamide.
What is the SMILES notation for 2-(2-fluorophenoxy)-N-[(2S)-1-(2-methylphenoxy)propan-2-yl]acetamide?
The canonical SMILES for 2-(2-fluorophenoxy)-N-[(2S)-1-(2-methylphenoxy)propan-2-yl]acetamide is Cc1ccccc1OC[C@H](C)NC(=O)COc1ccccc1F.
What is the InChIKey of 2-(2-fluorophenoxy)-N-[(2S)-1-(2-methylphenoxy)propan-2-yl]acetamide?
The InChIKey is MHNFQNFDOYNYFN-AWEZNQCLSA-N. The full InChI is InChI=1S/C18H20FNO3/c1-13-7-3-5-9-16(13)22-11-14(2)20-18(21)12-23-17-10-6-4-8-15(17)19/h3-10,14H,11-12H2,1-2H3,(H,20,21)/t14-/m0/s1.
What are the key properties of 2-(2-fluorophenoxy)-N-[(2S)-1-(2-methylphenoxy)propan-2-yl]acetamide?
2-(2-fluorophenoxy)-N-[(2S)-1-(2-methylphenoxy)propan-2-yl]acetamide has a molecular weight of 317.36 g/mol, XLogP of 3.10, 7 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(2-fluorophenoxy)-N-[(2S)-1-(2-methylphenoxy)propan-2-yl]acetamide is sourced from PubChem (CID 94623553), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).