2-amino-N-(2,2-difluoroethyl)-N-methyl-2-(oxan-4-yl)acetamide

C10H18F2N2O2 — CID 120790112

IUPAC2-amino-N-(2,2-difluoroethyl)-N-methyl-2-(oxan-4-yl)acetamide
SMILESCN(CC(F)F)C(=O)C(N)C1CCOCC1
InChIInChI=1S/C10H18F2N2O2/c1-14(6-8(11)12)10(15)9(13)7-2-4-16-5-3-7/h7-9H,2-6,13H2,1H3
InChIKeyWOFSZEVLIQOSQH-UHFFFAOYSA-N
MW236.26 g/mol
LogP0.46
Rot. Bonds4

About 2-amino-N-(2,2-difluoroethyl)-N-methyl-2-(oxan-4-yl)acetamide

2-amino-N-(2,2-difluoroethyl)-N-methyl-2-(oxan-4-yl)acetamide (PubChem CID 120790112) has the molecular formula C10H18F2N2O2 and a molecular weight of 236.26 g/mol. Its IUPAC name is 2-amino-N-(2,2-difluoroethyl)-N-methyl-2-(oxan-4-yl)acetamide.

Molecular Properties

Compound Name2-amino-N-(2,2-difluoroethyl)-N-methyl-2-(oxan-4-yl)acetamide
PubChem CID120790112
Molecular FormulaC10H18F2N2O2
Molecular Weight236.26 g/mol
Exact Mass236.13
IUPAC Name2-amino-N-(2,2-difluoroethyl)-N-methyl-2-(oxan-4-yl)acetamide
SMILESCN(CC(F)F)C(=O)C(N)C1CCOCC1
InChIInChI=1S/C10H18F2N2O2/c1-14(6-8(11)12)10(15)9(13)7-2-4-16-5-3-7/h7-9H,2-6,13H2,1H3
InChIKeyWOFSZEVLIQOSQH-UHFFFAOYSA-N
XLogP0.46
TPSA55.56 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500236.26
LogP ≤ 50.46
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 2-amino-N-(2,2-difluoroethyl)-N-methyl-2-(oxan-4-yl)acetamide?
The IUPAC name of 2-amino-N-(2,2-difluoroethyl)-N-methyl-2-(oxan-4-yl)acetamide (CID 120790112) is 2-amino-N-(2,2-difluoroethyl)-N-methyl-2-(oxan-4-yl)acetamide.
What is the SMILES notation for 2-amino-N-(2,2-difluoroethyl)-N-methyl-2-(oxan-4-yl)acetamide?
The canonical SMILES for 2-amino-N-(2,2-difluoroethyl)-N-methyl-2-(oxan-4-yl)acetamide is CN(CC(F)F)C(=O)C(N)C1CCOCC1.
What is the InChIKey of 2-amino-N-(2,2-difluoroethyl)-N-methyl-2-(oxan-4-yl)acetamide?
The InChIKey is WOFSZEVLIQOSQH-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H18F2N2O2/c1-14(6-8(11)12)10(15)9(13)7-2-4-16-5-3-7/h7-9H,2-6,13H2,1H3.
What are the key properties of 2-amino-N-(2,2-difluoroethyl)-N-methyl-2-(oxan-4-yl)acetamide?
2-amino-N-(2,2-difluoroethyl)-N-methyl-2-(oxan-4-yl)acetamide has a molecular weight of 236.26 g/mol, XLogP of 0.46, 4 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-amino-N-(2,2-difluoroethyl)-N-methyl-2-(oxan-4-yl)acetamide is sourced from PubChem (CID 120790112), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).