N-[(1R)-1-(4-fluorophenyl)ethyl]-2-methoxyacetamide

C11H14FNO2 — CID 81350028

IUPACN-[(1R)-1-(4-fluorophenyl)ethyl]-2-methoxyacetamide
SMILESCOCC(=O)N[C@H](C)c1ccc(F)cc1
InChIInChI=1S/C11H14FNO2/c1-8(13-11(14)7-15-2)9-3-5-10(12)6-4-9/h3-6,8H,7H2,1-2H3,(H,13,14)/t8-/m1/s1
InChIKeyOLELHHXRVJXPNT-MRVPVSSYSA-N
MW211.24 g/mol
LogP1.65
Rot. Bonds4

About N-[(1R)-1-(4-fluorophenyl)ethyl]-2-methoxyacetamide

N-[(1R)-1-(4-fluorophenyl)ethyl]-2-methoxyacetamide (PubChem CID 81350028) has the molecular formula C11H14FNO2 and a molecular weight of 211.24 g/mol. Its IUPAC name is N-[(1R)-1-(4-fluorophenyl)ethyl]-2-methoxyacetamide.

Molecular Properties

Compound NameN-[(1R)-1-(4-fluorophenyl)ethyl]-2-methoxyacetamide
PubChem CID81350028
Molecular FormulaC11H14FNO2
Molecular Weight211.24 g/mol
Exact Mass211.10
IUPAC NameN-[(1R)-1-(4-fluorophenyl)ethyl]-2-methoxyacetamide
SMILESCOCC(=O)N[C@H](C)c1ccc(F)cc1
InChIInChI=1S/C11H14FNO2/c1-8(13-11(14)7-15-2)9-3-5-10(12)6-4-9/h3-6,8H,7H2,1-2H3,(H,13,14)/t8-/m1/s1
InChIKeyOLELHHXRVJXPNT-MRVPVSSYSA-N
XLogP1.65
TPSA38.33 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500211.24
LogP ≤ 51.65
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of N-[(1R)-1-(4-fluorophenyl)ethyl]-2-methoxyacetamide?
The IUPAC name of N-[(1R)-1-(4-fluorophenyl)ethyl]-2-methoxyacetamide (CID 81350028) is N-[(1R)-1-(4-fluorophenyl)ethyl]-2-methoxyacetamide.
What is the SMILES notation for N-[(1R)-1-(4-fluorophenyl)ethyl]-2-methoxyacetamide?
The canonical SMILES for N-[(1R)-1-(4-fluorophenyl)ethyl]-2-methoxyacetamide is COCC(=O)N[C@H](C)c1ccc(F)cc1.
What is the InChIKey of N-[(1R)-1-(4-fluorophenyl)ethyl]-2-methoxyacetamide?
The InChIKey is OLELHHXRVJXPNT-MRVPVSSYSA-N. The full InChI is InChI=1S/C11H14FNO2/c1-8(13-11(14)7-15-2)9-3-5-10(12)6-4-9/h3-6,8H,7H2,1-2H3,(H,13,14)/t8-/m1/s1.
What are the key properties of N-[(1R)-1-(4-fluorophenyl)ethyl]-2-methoxyacetamide?
N-[(1R)-1-(4-fluorophenyl)ethyl]-2-methoxyacetamide has a molecular weight of 211.24 g/mol, XLogP of 1.65, 4 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-[(1R)-1-(4-fluorophenyl)ethyl]-2-methoxyacetamide is sourced from PubChem (CID 81350028), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).