N-[(4-fluorophenyl)methyl]-2-methoxy-N-methylacetamide

C11H14FNO2 — CID 60636060

IUPACN-[(4-fluorophenyl)methyl]-2-methoxy-N-methylacetamide
SMILESCOCC(=O)N(C)Cc1ccc(F)cc1
InChIInChI=1S/C11H14FNO2/c1-13(11(14)8-15-2)7-9-3-5-10(12)6-4-9/h3-6H,7-8H2,1-2H3
InChIKeyDLKFGYUUJVXKIT-UHFFFAOYSA-N
MW211.24 g/mol
LogP1.43
Rot. Bonds4

About N-[(4-fluorophenyl)methyl]-2-methoxy-N-methylacetamide

N-[(4-fluorophenyl)methyl]-2-methoxy-N-methylacetamide (PubChem CID 60636060) has the molecular formula C11H14FNO2 and a molecular weight of 211.24 g/mol. Its IUPAC name is N-[(4-fluorophenyl)methyl]-2-methoxy-N-methylacetamide.

Molecular Properties

Compound NameN-[(4-fluorophenyl)methyl]-2-methoxy-N-methylacetamide
PubChem CID60636060
Molecular FormulaC11H14FNO2
Molecular Weight211.24 g/mol
Exact Mass211.10
IUPAC NameN-[(4-fluorophenyl)methyl]-2-methoxy-N-methylacetamide
SMILESCOCC(=O)N(C)Cc1ccc(F)cc1
InChIInChI=1S/C11H14FNO2/c1-13(11(14)8-15-2)7-9-3-5-10(12)6-4-9/h3-6H,7-8H2,1-2H3
InChIKeyDLKFGYUUJVXKIT-UHFFFAOYSA-N
XLogP1.43
TPSA29.54 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500211.24
LogP ≤ 51.43
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of N-[(4-fluorophenyl)methyl]-2-methoxy-N-methylacetamide?
The IUPAC name of N-[(4-fluorophenyl)methyl]-2-methoxy-N-methylacetamide (CID 60636060) is N-[(4-fluorophenyl)methyl]-2-methoxy-N-methylacetamide.
What is the SMILES notation for N-[(4-fluorophenyl)methyl]-2-methoxy-N-methylacetamide?
The canonical SMILES for N-[(4-fluorophenyl)methyl]-2-methoxy-N-methylacetamide is COCC(=O)N(C)Cc1ccc(F)cc1.
What is the InChIKey of N-[(4-fluorophenyl)methyl]-2-methoxy-N-methylacetamide?
The InChIKey is DLKFGYUUJVXKIT-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H14FNO2/c1-13(11(14)8-15-2)7-9-3-5-10(12)6-4-9/h3-6H,7-8H2,1-2H3.
What are the key properties of N-[(4-fluorophenyl)methyl]-2-methoxy-N-methylacetamide?
N-[(4-fluorophenyl)methyl]-2-methoxy-N-methylacetamide has a molecular weight of 211.24 g/mol, XLogP of 1.43, 4 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-[(4-fluorophenyl)methyl]-2-methoxy-N-methylacetamide is sourced from PubChem (CID 60636060), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).