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

C13H16F2N2O2 — CID 120785988

IUPAC2-amino-N-(2,3-difluorophenyl)-2-(oxan-4-yl)acetamide
SMILESNC(C(=O)Nc1cccc(F)c1F)C1CCOCC1
InChIInChI=1S/C13H16F2N2O2/c14-9-2-1-3-10(11(9)15)17-13(18)12(16)8-4-6-19-7-5-8/h1-3,8,12H,4-7,16H2,(H,17,18)
InChIKeyGDBCFRHOQOPBNQ-UHFFFAOYSA-N
MW270.28 g/mol
LogP1.66
Rot. Bonds3

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

2-amino-N-(2,3-difluorophenyl)-2-(oxan-4-yl)acetamide (PubChem CID 120785988) has the molecular formula C13H16F2N2O2 and a molecular weight of 270.28 g/mol. Its IUPAC name is 2-amino-N-(2,3-difluorophenyl)-2-(oxan-4-yl)acetamide.

Molecular Properties

Compound Name2-amino-N-(2,3-difluorophenyl)-2-(oxan-4-yl)acetamide
PubChem CID120785988
Molecular FormulaC13H16F2N2O2
Molecular Weight270.28 g/mol
Exact Mass270.12
IUPAC Name2-amino-N-(2,3-difluorophenyl)-2-(oxan-4-yl)acetamide
SMILESNC(C(=O)Nc1cccc(F)c1F)C1CCOCC1
InChIInChI=1S/C13H16F2N2O2/c14-9-2-1-3-10(11(9)15)17-13(18)12(16)8-4-6-19-7-5-8/h1-3,8,12H,4-7,16H2,(H,17,18)
InChIKeyGDBCFRHOQOPBNQ-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

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Related Compounds

2-amino-N-[2-(2,3-difluorophenyl)ethyl]-2-(oxan-4-yl)acetamide
CID 120793248
2-amino-2-(oxan-4-yl)-N-(2,4,5-trifluorophenyl)acetamide;hydrochloride
CID 120786077
2-amino-N-[2-methyl-3-(trifluoromethyl)phenyl]-2-(oxan-4-yl)acetamide
CID 120786132
2-amino-2-(oxan-4-yl)-N-(5,6,7,8-tetrahydronaphthalen-1-yl)acetamide
CID 120783058
2-amino-N-[2-(2,6-difluorophenyl)ethyl]-2-(oxan-4-yl)acetamide;hydrochloride
CID 120787345
2-amino-N-(3,4-difluorophenyl)-2-(oxan-4-yl)acetamide
CID 120782962
2-amino-N-(4-fluoro-2-methylphenyl)-2-(oxan-4-yl)acetamide
CID 120783512
2-amino-N-(4-fluoro-2,3-dihydro-1H-inden-1-yl)-2-(oxan-4-yl)acetamide;hydrochloride
CID 120789561
2-amino-N-[2-methyl-3-(2,2,2-trifluoroethoxy)phenyl]-2-(oxan-4-yl)acetamide
CID 120791678
2-amino-N-[2-methyl-3-(methylsulfamoyl)phenyl]-2-(oxan-4-yl)acetamide;hydrochloride
CID 120796053
N-(3-acetamido-4-fluorophenyl)-2-amino-2-(oxan-4-yl)acetamide;hydrochloride
CID 120785529
2-amino-N-(2,3-difluorophenyl)-3-methylbutanamide;hydrochloride
CID 119280847

Frequently Asked Questions

What is the IUPAC name of 2-amino-N-(2,3-difluorophenyl)-2-(oxan-4-yl)acetamide?
The IUPAC name of 2-amino-N-(2,3-difluorophenyl)-2-(oxan-4-yl)acetamide (CID 120785988) is 2-amino-N-(2,3-difluorophenyl)-2-(oxan-4-yl)acetamide.
What is the SMILES notation for 2-amino-N-(2,3-difluorophenyl)-2-(oxan-4-yl)acetamide?
The canonical SMILES for 2-amino-N-(2,3-difluorophenyl)-2-(oxan-4-yl)acetamide is NC(C(=O)Nc1cccc(F)c1F)C1CCOCC1.
What is the InChIKey of 2-amino-N-(2,3-difluorophenyl)-2-(oxan-4-yl)acetamide?
The InChIKey is GDBCFRHOQOPBNQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H16F2N2O2/c14-9-2-1-3-10(11(9)15)17-13(18)12(16)8-4-6-19-7-5-8/h1-3,8,12H,4-7,16H2,(H,17,18).
What are the key properties of 2-amino-N-(2,3-difluorophenyl)-2-(oxan-4-yl)acetamide?
2-amino-N-(2,3-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-(2,3-difluorophenyl)-2-(oxan-4-yl)acetamide is sourced from PubChem (CID 120785988), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).