2-amino-N-[1-(2,4-difluorophenyl)ethyl]-2-ethylbutanamide

C14H20F2N2O — CID 79810222

IUPAC2-amino-N-[1-(2,4-difluorophenyl)ethyl]-2-ethylbutanamide
SMILESCCC(N)(CC)C(=O)NC(C)c1ccc(F)cc1F
InChIInChI=1S/C14H20F2N2O/c1-4-14(17,5-2)13(19)18-9(3)11-7-6-10(15)8-12(11)16/h6-9H,4-5,17H2,1-3H3,(H,18,19)
InChIKeyKKNHUNQHOFENLJ-UHFFFAOYSA-N
MW270.32 g/mol
LogP2.66
Rot. Bonds5

About 2-amino-N-[1-(2,4-difluorophenyl)ethyl]-2-ethylbutanamide

2-amino-N-[1-(2,4-difluorophenyl)ethyl]-2-ethylbutanamide (PubChem CID 79810222) has the molecular formula C14H20F2N2O and a molecular weight of 270.32 g/mol. Its IUPAC name is 2-amino-N-[1-(2,4-difluorophenyl)ethyl]-2-ethylbutanamide.

Molecular Properties

Compound Name2-amino-N-[1-(2,4-difluorophenyl)ethyl]-2-ethylbutanamide
PubChem CID79810222
Molecular FormulaC14H20F2N2O
Molecular Weight270.32 g/mol
Exact Mass270.15
IUPAC Name2-amino-N-[1-(2,4-difluorophenyl)ethyl]-2-ethylbutanamide
SMILESCCC(N)(CC)C(=O)NC(C)c1ccc(F)cc1F
InChIInChI=1S/C14H20F2N2O/c1-4-14(17,5-2)13(19)18-9(3)11-7-6-10(15)8-12(11)16/h6-9H,4-5,17H2,1-3H3,(H,18,19)
InChIKeyKKNHUNQHOFENLJ-UHFFFAOYSA-N
XLogP2.66
TPSA55.12 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds5
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500270.32
LogP ≤ 52.66
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

Analyze 2-amino-N-[1-(2,4-difluorophenyl)ethyl]-2-ethylbutanamide with MolForge

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

Launch Full Analysis

Related Compounds

2-amino-2-ethyl-N-[1-(3-fluorophenyl)ethyl]butanamide
CID 79814759
(2S)-2-amino-N-[1-(2,4-difluorophenyl)ethyl]butanamide;hydrochloride
CID 119269517
N-[1-(2,4-difluorophenyl)ethyl]-2,2,3,3-tetrafluoropropanamide
CID 103732061
ethyl N-[1-(2,4-difluorophenyl)ethyl]carbamate
CID 60638339
2-(tert-butylamino)-N-[(1R)-1-(2,4-difluorophenyl)ethyl]acetamide
CID 31311994
1-[1-(2,4-difluorophenyl)ethyl]-3-(4-hydroxy-3-methylbutan-2-yl)urea
CID 111453811
N-[1-(2,4-difluorophenyl)ethyl]-2-oxopropanamide
CID 70339940
2-amino-N-[1-(2,4-difluorophenyl)ethyl]-3-methylbutanamide
CID 43702013
3-(aminomethyl)-N-[1-(2,4-difluorophenyl)ethyl]pentanamide
CID 81075854
2-amino-N-[1-[2-(difluoromethoxy)phenyl]ethyl]-2-ethylbutanamide
CID 79813978
N-[1-(2,4-difluorophenyl)ethyl]-2,4-difluorobenzamide
CID 51150419
2-[2-[[(1R)-1-(2,4-difluorophenyl)ethyl]amino]-2-oxoethyl]sulfanylacetamide
CID 94081336

Frequently Asked Questions

What is the IUPAC name of 2-amino-N-[1-(2,4-difluorophenyl)ethyl]-2-ethylbutanamide?
The IUPAC name of 2-amino-N-[1-(2,4-difluorophenyl)ethyl]-2-ethylbutanamide (CID 79810222) is 2-amino-N-[1-(2,4-difluorophenyl)ethyl]-2-ethylbutanamide.
What is the SMILES notation for 2-amino-N-[1-(2,4-difluorophenyl)ethyl]-2-ethylbutanamide?
The canonical SMILES for 2-amino-N-[1-(2,4-difluorophenyl)ethyl]-2-ethylbutanamide is CCC(N)(CC)C(=O)NC(C)c1ccc(F)cc1F.
What is the InChIKey of 2-amino-N-[1-(2,4-difluorophenyl)ethyl]-2-ethylbutanamide?
The InChIKey is KKNHUNQHOFENLJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H20F2N2O/c1-4-14(17,5-2)13(19)18-9(3)11-7-6-10(15)8-12(11)16/h6-9H,4-5,17H2,1-3H3,(H,18,19).
What are the key properties of 2-amino-N-[1-(2,4-difluorophenyl)ethyl]-2-ethylbutanamide?
2-amino-N-[1-(2,4-difluorophenyl)ethyl]-2-ethylbutanamide has a molecular weight of 270.32 g/mol, XLogP of 2.66, 5 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-amino-N-[1-(2,4-difluorophenyl)ethyl]-2-ethylbutanamide is sourced from PubChem (CID 79810222), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).