(2S)-2-amino-N-(2,2-difluoroethyl)-N-(2-methoxyethyl)propanamide

C8H16F2N2O2 — CID 119314780

IUPAC(2S)-2-amino-N-(2,2-difluoroethyl)-N-(2-methoxyethyl)propanamide
SMILESCOCCN(CC(F)F)C(=O)[C@H](C)N
InChIInChI=1S/C8H16F2N2O2/c1-6(11)8(13)12(3-4-14-2)5-7(9)10/h6-7H,3-5,11H2,1-2H3/t6-/m0/s1
InChIKeyIOCPVKKKVMVJLS-LURJTMIESA-N
MW210.22 g/mol
LogP0.07
Rot. Bonds6

About (2S)-2-amino-N-(2,2-difluoroethyl)-N-(2-methoxyethyl)propanamide

(2S)-2-amino-N-(2,2-difluoroethyl)-N-(2-methoxyethyl)propanamide (PubChem CID 119314780) has the molecular formula C8H16F2N2O2 and a molecular weight of 210.22 g/mol. Its IUPAC name is (2S)-2-amino-N-(2,2-difluoroethyl)-N-(2-methoxyethyl)propanamide.

Molecular Properties

Compound Name(2S)-2-amino-N-(2,2-difluoroethyl)-N-(2-methoxyethyl)propanamide
PubChem CID119314780
Molecular FormulaC8H16F2N2O2
Molecular Weight210.22 g/mol
Exact Mass210.12
IUPAC Name(2S)-2-amino-N-(2,2-difluoroethyl)-N-(2-methoxyethyl)propanamide
SMILESCOCCN(CC(F)F)C(=O)[C@H](C)N
InChIInChI=1S/C8H16F2N2O2/c1-6(11)8(13)12(3-4-14-2)5-7(9)10/h6-7H,3-5,11H2,1-2H3/t6-/m0/s1
InChIKeyIOCPVKKKVMVJLS-LURJTMIESA-N
XLogP0.07
TPSA55.56 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds6
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500210.22
LogP ≤ 50.07
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Analyze (2S)-2-amino-N-(2,2-difluoroethyl)-N-(2-methoxyethyl)propanamide 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

(2S)-2-amino-N-(2-methoxyethyl)-3-methyl-N-(2-methylpropyl)butanamide
CID 61162971
N-(2-aminoethyl)-N-(2,2-difluoroethyl)-2-methoxypropanamide
CID 107493240
2-amino-4-methoxy-N-(2-methoxyethyl)-N-(2-methylpropyl)butanamide
CID 62473959
4-amino-N-(2,2-difluoroethyl)-3-methoxy-N-(2-methoxyethyl)butanamide;hydrochloride
CID 120591334
(2S)-2-amino-N-[2-(4-fluorophenoxy)ethyl]-N-(2-methoxyethyl)propanamide;hydrochloride
CID 119321215
3-amino-N-(2,2-difluoroethyl)-N-(2-methoxyethyl)-3-phenylpropanamide
CID 119951069
(2S)-2-amino-N-ethyl-N-(2-methoxyethyl)-3-methylbutanamide
CID 61447181
N-(2-methoxyethyl)-2-methyl-N-(2-methylpropyl)butanamide
CID 78854118
3-[2-methoxyethyl(2-methylpropyl)amino]-2-methyl-3-oxopropanoic acid
CID 114897540
2,2-difluoro-N-(2-hydroxyethyl)-N-(2-methoxyethyl)acetamide
CID 103513987
2-amino-N-(3-methoxypropyl)-N-methylpropanamide
CID 63010028
2-amino-N-ethyl-N-(2-methoxyethyl)-3-methylpentanamide
CID 61446871

Frequently Asked Questions

What is the IUPAC name of (2S)-2-amino-N-(2,2-difluoroethyl)-N-(2-methoxyethyl)propanamide?
The IUPAC name of (2S)-2-amino-N-(2,2-difluoroethyl)-N-(2-methoxyethyl)propanamide (CID 119314780) is (2S)-2-amino-N-(2,2-difluoroethyl)-N-(2-methoxyethyl)propanamide.
What is the SMILES notation for (2S)-2-amino-N-(2,2-difluoroethyl)-N-(2-methoxyethyl)propanamide?
The canonical SMILES for (2S)-2-amino-N-(2,2-difluoroethyl)-N-(2-methoxyethyl)propanamide is COCCN(CC(F)F)C(=O)[C@H](C)N.
What is the InChIKey of (2S)-2-amino-N-(2,2-difluoroethyl)-N-(2-methoxyethyl)propanamide?
The InChIKey is IOCPVKKKVMVJLS-LURJTMIESA-N. The full InChI is InChI=1S/C8H16F2N2O2/c1-6(11)8(13)12(3-4-14-2)5-7(9)10/h6-7H,3-5,11H2,1-2H3/t6-/m0/s1.
What are the key properties of (2S)-2-amino-N-(2,2-difluoroethyl)-N-(2-methoxyethyl)propanamide?
(2S)-2-amino-N-(2,2-difluoroethyl)-N-(2-methoxyethyl)propanamide has a molecular weight of 210.22 g/mol, XLogP of 0.07, 6 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for (2S)-2-amino-N-(2,2-difluoroethyl)-N-(2-methoxyethyl)propanamide is sourced from PubChem (CID 119314780), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).