N,N-diethyl-2-[(4-fluorophenyl)methylamino]acetamide

C13H19FN2O — CID 28581599

IUPACN,N-diethyl-2-[(4-fluorophenyl)methylamino]acetamide
SMILESCCN(CC)C(=O)CNCc1ccc(F)cc1
InChIInChI=1S/C13H19FN2O/c1-3-16(4-2)13(17)10-15-9-11-5-7-12(14)8-6-11/h5-8,15H,3-4,9-10H2,1-2H3
InChIKeyQPZQJUGNNPVSLS-UHFFFAOYSA-N
MW238.31 g/mol
LogP1.78
Rot. Bonds6

About N,N-diethyl-2-[(4-fluorophenyl)methylamino]acetamide

N,N-diethyl-2-[(4-fluorophenyl)methylamino]acetamide (PubChem CID 28581599) has the molecular formula C13H19FN2O and a molecular weight of 238.31 g/mol. Its IUPAC name is N,N-diethyl-2-[(4-fluorophenyl)methylamino]acetamide.

Molecular Properties

Compound NameN,N-diethyl-2-[(4-fluorophenyl)methylamino]acetamide
PubChem CID28581599
Molecular FormulaC13H19FN2O
Molecular Weight238.31 g/mol
Exact Mass238.15
IUPAC NameN,N-diethyl-2-[(4-fluorophenyl)methylamino]acetamide
SMILESCCN(CC)C(=O)CNCc1ccc(F)cc1
InChIInChI=1S/C13H19FN2O/c1-3-16(4-2)13(17)10-15-9-11-5-7-12(14)8-6-11/h5-8,15H,3-4,9-10H2,1-2H3
InChIKeyQPZQJUGNNPVSLS-UHFFFAOYSA-N
XLogP1.78
TPSA32.34 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds6
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500238.31
LogP ≤ 51.78
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

N,N-diethyl-2-[2-(4-fluorophenyl)ethylamino]acetamide
CID 28570858
2-[(3,5-difluorophenyl)methylamino]-N,N-diethylacetamide
CID 115767711
2-(benzylamino)-N,N-diethylacetamide
CID 10857021
N,N-diethyl-2-[(3-fluoro-4-hydroxyphenyl)methylamino]acetamide
CID 107685979
1,1-diethyl-3-[(4-fluorophenyl)methyl]urea
CID 3851579
2-[(4-fluorophenyl)methylamino]-N-methyl-N-propan-2-ylacetamide
CID 28581707
2-[(4-fluorophenyl)methylamino]-N-methyl-N-phenylacetamide
CID 108997751
2-[(3,5-dimethylphenyl)methylamino]-N,N-diethylacetamide
CID 112687465
N,N-diethyl-2-[(2-fluorophenyl)methylamino]acetamide
CID 28582548
N-[(4-fluorophenyl)methyl]ethanamine
CID 4716481
N,N-diethyl-2-[[(2S)-1-(4-fluorophenyl)-3-methylbutan-2-yl]amino]acetamide
CID 97321937
N-[(4-fluorophenyl)methyl]-2-[(4-fluorophenyl)methylamino]acetamide
CID 108997698

Frequently Asked Questions

What is the IUPAC name of N,N-diethyl-2-[(4-fluorophenyl)methylamino]acetamide?
The IUPAC name of N,N-diethyl-2-[(4-fluorophenyl)methylamino]acetamide (CID 28581599) is N,N-diethyl-2-[(4-fluorophenyl)methylamino]acetamide.
What is the SMILES notation for N,N-diethyl-2-[(4-fluorophenyl)methylamino]acetamide?
The canonical SMILES for N,N-diethyl-2-[(4-fluorophenyl)methylamino]acetamide is CCN(CC)C(=O)CNCc1ccc(F)cc1.
What is the InChIKey of N,N-diethyl-2-[(4-fluorophenyl)methylamino]acetamide?
The InChIKey is QPZQJUGNNPVSLS-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H19FN2O/c1-3-16(4-2)13(17)10-15-9-11-5-7-12(14)8-6-11/h5-8,15H,3-4,9-10H2,1-2H3.
What are the key properties of N,N-diethyl-2-[(4-fluorophenyl)methylamino]acetamide?
N,N-diethyl-2-[(4-fluorophenyl)methylamino]acetamide has a molecular weight of 238.31 g/mol, XLogP of 1.78, 6 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N,N-diethyl-2-[(4-fluorophenyl)methylamino]acetamide is sourced from PubChem (CID 28581599), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).