N,N-diethyl-2-[4-fluoro-2-[(1R)-1-hydroxyethyl]-N-methylanilino]acetamide

C15H23FN2O2 — CID 63371189

IUPACN,N-diethyl-2-[4-fluoro-2-[(1R)-1-hydroxyethyl]-N-methylanilino]acetamide
SMILESCCN(CC)C(=O)CN(C)c1ccc(F)cc1[C@@H](C)O
InChIInChI=1S/C15H23FN2O2/c1-5-18(6-2)15(20)10-17(4)14-8-7-12(16)9-13(14)11(3)19/h7-9,11,19H,5-6,10H2,1-4H3/t11-/m1/s1
InChIKeyZFUBQUROHMUUSC-LLVKDONJSA-N
MW282.36 g/mol
LogP2.18
Rot. Bonds6

About N,N-diethyl-2-[4-fluoro-2-[(1R)-1-hydroxyethyl]-N-methylanilino]acetamide

N,N-diethyl-2-[4-fluoro-2-[(1R)-1-hydroxyethyl]-N-methylanilino]acetamide (PubChem CID 63371189) has the molecular formula C15H23FN2O2 and a molecular weight of 282.36 g/mol. Its IUPAC name is N,N-diethyl-2-[4-fluoro-2-[(1R)-1-hydroxyethyl]-N-methylanilino]acetamide.

Molecular Properties

Compound NameN,N-diethyl-2-[4-fluoro-2-[(1R)-1-hydroxyethyl]-N-methylanilino]acetamide
PubChem CID63371189
Molecular FormulaC15H23FN2O2
Molecular Weight282.36 g/mol
Exact Mass282.17
IUPAC NameN,N-diethyl-2-[4-fluoro-2-[(1R)-1-hydroxyethyl]-N-methylanilino]acetamide
SMILESCCN(CC)C(=O)CN(C)c1ccc(F)cc1[C@@H](C)O
InChIInChI=1S/C15H23FN2O2/c1-5-18(6-2)15(20)10-17(4)14-8-7-12(16)9-13(14)11(3)19/h7-9,11,19H,5-6,10H2,1-4H3/t11-/m1/s1
InChIKeyZFUBQUROHMUUSC-LLVKDONJSA-N
XLogP2.18
TPSA43.78 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds6
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500282.36
LogP ≤ 52.18
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Analyze N,N-diethyl-2-[4-fluoro-2-[(1R)-1-hydroxyethyl]-N-methylanilino]acetamide with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Frequently Asked Questions

What is the IUPAC name of N,N-diethyl-2-[4-fluoro-2-[(1R)-1-hydroxyethyl]-N-methylanilino]acetamide?
The IUPAC name of N,N-diethyl-2-[4-fluoro-2-[(1R)-1-hydroxyethyl]-N-methylanilino]acetamide (CID 63371189) is N,N-diethyl-2-[4-fluoro-2-[(1R)-1-hydroxyethyl]-N-methylanilino]acetamide.
What is the SMILES notation for N,N-diethyl-2-[4-fluoro-2-[(1R)-1-hydroxyethyl]-N-methylanilino]acetamide?
The canonical SMILES for N,N-diethyl-2-[4-fluoro-2-[(1R)-1-hydroxyethyl]-N-methylanilino]acetamide is CCN(CC)C(=O)CN(C)c1ccc(F)cc1[C@@H](C)O.
What is the InChIKey of N,N-diethyl-2-[4-fluoro-2-[(1R)-1-hydroxyethyl]-N-methylanilino]acetamide?
The InChIKey is ZFUBQUROHMUUSC-LLVKDONJSA-N. The full InChI is InChI=1S/C15H23FN2O2/c1-5-18(6-2)15(20)10-17(4)14-8-7-12(16)9-13(14)11(3)19/h7-9,11,19H,5-6,10H2,1-4H3/t11-/m1/s1.
What are the key properties of N,N-diethyl-2-[4-fluoro-2-[(1R)-1-hydroxyethyl]-N-methylanilino]acetamide?
N,N-diethyl-2-[4-fluoro-2-[(1R)-1-hydroxyethyl]-N-methylanilino]acetamide has a molecular weight of 282.36 g/mol, XLogP of 2.18, 6 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N,N-diethyl-2-[4-fluoro-2-[(1R)-1-hydroxyethyl]-N-methylanilino]acetamide is sourced from PubChem (CID 63371189), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).