2-[1-(2,6-difluorophenyl)ethylamino]-N,N-diethylpropanamide

C15H22F2N2O — CID 43739406

IUPAC2-[1-(2,6-difluorophenyl)ethylamino]-N,N-diethylpropanamide
SMILESCCN(CC)C(=O)C(C)NC(C)c1c(F)cccc1F
InChIInChI=1S/C15H22F2N2O/c1-5-19(6-2)15(20)11(4)18-10(3)14-12(16)8-7-9-13(14)17/h7-11,18H,5-6H2,1-4H3
InChIKeyWWKYDBSFKYAAKO-UHFFFAOYSA-N
MW284.35 g/mol
LogP2.87
Rot. Bonds6

About 2-[1-(2,6-difluorophenyl)ethylamino]-N,N-diethylpropanamide

2-[1-(2,6-difluorophenyl)ethylamino]-N,N-diethylpropanamide (PubChem CID 43739406) has the molecular formula C15H22F2N2O and a molecular weight of 284.35 g/mol. Its IUPAC name is 2-[1-(2,6-difluorophenyl)ethylamino]-N,N-diethylpropanamide.

Molecular Properties

Compound Name2-[1-(2,6-difluorophenyl)ethylamino]-N,N-diethylpropanamide
PubChem CID43739406
Molecular FormulaC15H22F2N2O
Molecular Weight284.35 g/mol
Exact Mass284.17
IUPAC Name2-[1-(2,6-difluorophenyl)ethylamino]-N,N-diethylpropanamide
SMILESCCN(CC)C(=O)C(C)NC(C)c1c(F)cccc1F
InChIInChI=1S/C15H22F2N2O/c1-5-19(6-2)15(20)11(4)18-10(3)14-12(16)8-7-9-13(14)17/h7-11,18H,5-6H2,1-4H3
InChIKeyWWKYDBSFKYAAKO-UHFFFAOYSA-N
XLogP2.87
TPSA32.34 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds6
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500284.35
LogP ≤ 52.87
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

ethyl 2-[1-(2,6-difluorophenyl)ethylamino]propanoate
CID 54960329
2-[1-(3-bromophenyl)ethylamino]-N,N-diethylpropanamide
CID 43426627
N,N-diethyl-2-[[(1S)-1-pyridin-4-ylethyl]amino]propanamide
CID 81405715
N,N-diethyl-2-[1-(4-fluorophenyl)propan-2-ylamino]propanamide
CID 62996918
2-[1-(5-bromofuran-2-yl)ethylamino]-N,N-diethylpropanamide
CID 104652645
2-[1-(2,6-difluorophenyl)ethylamino]-1-morpholin-4-ylpropan-1-one
CID 115588993
N,N-diethyl-2-[(2-methyl-1-phenylpropyl)amino]propanamide
CID 43425569
2-[1-(3,5-dimethyl-1,2-oxazol-4-yl)ethylamino]-N,N-diethylpropanamide
CID 78961648
2-[1-(2,6-difluorophenyl)ethylamino]-3-methylbutan-1-ol
CID 79253650
N-ethyl-2-[1-(3-fluorophenyl)ethylamino]-N-methylpropanamide
CID 103106950
N,N-diethyl-2-(4-phenylbutan-2-ylamino)propanamide
CID 43425172
2-N-[1-(2,6-difluorophenyl)ethyl]propane-1,2-diamine
CID 103389171

Frequently Asked Questions

What is the IUPAC name of 2-[1-(2,6-difluorophenyl)ethylamino]-N,N-diethylpropanamide?
The IUPAC name of 2-[1-(2,6-difluorophenyl)ethylamino]-N,N-diethylpropanamide (CID 43739406) is 2-[1-(2,6-difluorophenyl)ethylamino]-N,N-diethylpropanamide.
What is the SMILES notation for 2-[1-(2,6-difluorophenyl)ethylamino]-N,N-diethylpropanamide?
The canonical SMILES for 2-[1-(2,6-difluorophenyl)ethylamino]-N,N-diethylpropanamide is CCN(CC)C(=O)C(C)NC(C)c1c(F)cccc1F.
What is the InChIKey of 2-[1-(2,6-difluorophenyl)ethylamino]-N,N-diethylpropanamide?
The InChIKey is WWKYDBSFKYAAKO-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H22F2N2O/c1-5-19(6-2)15(20)11(4)18-10(3)14-12(16)8-7-9-13(14)17/h7-11,18H,5-6H2,1-4H3.
What are the key properties of 2-[1-(2,6-difluorophenyl)ethylamino]-N,N-diethylpropanamide?
2-[1-(2,6-difluorophenyl)ethylamino]-N,N-diethylpropanamide has a molecular weight of 284.35 g/mol, XLogP of 2.87, 6 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[1-(2,6-difluorophenyl)ethylamino]-N,N-diethylpropanamide is sourced from PubChem (CID 43739406), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).