2-amino-N-(3,4-difluorophenyl)-2-(oxan-4-yl)acetamide

C13H16F2N2O2 — CID 120782962

IUPAC2-amino-N-(3,4-difluorophenyl)-2-(oxan-4-yl)acetamide
SMILESNC(C(=O)Nc1ccc(F)c(F)c1)C1CCOCC1
InChIInChI=1S/C13H16F2N2O2/c14-10-2-1-9(7-11(10)15)17-13(18)12(16)8-3-5-19-6-4-8/h1-2,7-8,12H,3-6,16H2,(H,17,18)
InChIKeyCPJSNWPXSCSESZ-UHFFFAOYSA-N
MW270.28 g/mol
LogP1.66
Rot. Bonds3

About 2-amino-N-(3,4-difluorophenyl)-2-(oxan-4-yl)acetamide

2-amino-N-(3,4-difluorophenyl)-2-(oxan-4-yl)acetamide (PubChem CID 120782962) has the molecular formula C13H16F2N2O2 and a molecular weight of 270.28 g/mol. Its IUPAC name is 2-amino-N-(3,4-difluorophenyl)-2-(oxan-4-yl)acetamide.

Molecular Properties

Compound Name2-amino-N-(3,4-difluorophenyl)-2-(oxan-4-yl)acetamide
PubChem CID120782962
Molecular FormulaC13H16F2N2O2
Molecular Weight270.28 g/mol
Exact Mass270.12
IUPAC Name2-amino-N-(3,4-difluorophenyl)-2-(oxan-4-yl)acetamide
SMILESNC(C(=O)Nc1ccc(F)c(F)c1)C1CCOCC1
InChIInChI=1S/C13H16F2N2O2/c14-10-2-1-9(7-11(10)15)17-13(18)12(16)8-3-5-19-6-4-8/h1-2,7-8,12H,3-6,16H2,(H,17,18)
InChIKeyCPJSNWPXSCSESZ-UHFFFAOYSA-N
XLogP1.66
TPSA64.35 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500270.28
LogP ≤ 51.66
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

Analyze 2-amino-N-(3,4-difluorophenyl)-2-(oxan-4-yl)acetamide 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

N-(3-acetamido-4-fluorophenyl)-2-amino-2-(oxan-4-yl)acetamide;hydrochloride
CID 120785529
2-amino-N-(3,5-difluoro-4-trimethylsilylphenyl)-2-(oxan-4-yl)acetamide
CID 140781478
2-amino-N-(3-chlorophenyl)-2-(oxan-4-yl)acetamide
CID 120782718
2-amino-2-(oxan-4-yl)-N-(2,4,5-trifluorophenyl)acetamide;hydrochloride
CID 120786077
N-[4-[[2-amino-2-(oxan-4-yl)acetyl]amino]phenyl]-4-chlorobenzamide;hydrochloride
CID 120789553
2-amino-N-(3-iodo-4-methylphenyl)-2-(oxan-4-yl)acetamide
CID 120783594
2-amino-N-(2,2-difluoro-1,3-benzodioxol-5-yl)-2-(oxan-4-yl)acetamide;hydrochloride
CID 120784707
2-amino-N-[1-(3,4-difluorophenyl)ethyl]-2-(oxan-4-yl)acetamide;hydrochloride
CID 120784097
2-amino-N-[3-fluoro-4-(oxolan-2-ylmethylamino)phenyl]-2-(oxan-4-yl)acetamide;dihydrochloride
CID 120800997
2-amino-N-(3-methylphenyl)-2-(oxan-4-yl)acetamide
CID 120782660
N-(3-acetamidophenyl)-2-amino-2-(oxan-4-yl)acetamide;hydrochloride
CID 120782773
N-(3,4-difluorophenyl)oxane-4-carboxamide
CID 31963323

Frequently Asked Questions

What is the IUPAC name of 2-amino-N-(3,4-difluorophenyl)-2-(oxan-4-yl)acetamide?
The IUPAC name of 2-amino-N-(3,4-difluorophenyl)-2-(oxan-4-yl)acetamide (CID 120782962) is 2-amino-N-(3,4-difluorophenyl)-2-(oxan-4-yl)acetamide.
What is the SMILES notation for 2-amino-N-(3,4-difluorophenyl)-2-(oxan-4-yl)acetamide?
The canonical SMILES for 2-amino-N-(3,4-difluorophenyl)-2-(oxan-4-yl)acetamide is NC(C(=O)Nc1ccc(F)c(F)c1)C1CCOCC1.
What is the InChIKey of 2-amino-N-(3,4-difluorophenyl)-2-(oxan-4-yl)acetamide?
The InChIKey is CPJSNWPXSCSESZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H16F2N2O2/c14-10-2-1-9(7-11(10)15)17-13(18)12(16)8-3-5-19-6-4-8/h1-2,7-8,12H,3-6,16H2,(H,17,18).
What are the key properties of 2-amino-N-(3,4-difluorophenyl)-2-(oxan-4-yl)acetamide?
2-amino-N-(3,4-difluorophenyl)-2-(oxan-4-yl)acetamide has a molecular weight of 270.28 g/mol, XLogP of 1.66, 3 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-amino-N-(3,4-difluorophenyl)-2-(oxan-4-yl)acetamide is sourced from PubChem (CID 120782962), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).