2,2-difluoro-N-methyl-3-(methylamino)propanamide

C5H10F2N2O — CID 14093529

IUPAC2,2-difluoro-N-methyl-3-(methylamino)propanamide
SMILESCNCC(F)(F)C(=O)NC
InChIInChI=1S/C5H10F2N2O/c1-8-3-5(6,7)4(10)9-2/h8H,3H2,1-2H3,(H,9,10)
InChIKeyZKSPWIIWWQWXTF-UHFFFAOYSA-N
MW152.14 g/mol
LogP-0.41
Rot. Bonds3

About 2,2-difluoro-N-methyl-3-(methylamino)propanamide

2,2-difluoro-N-methyl-3-(methylamino)propanamide (PubChem CID 14093529) has the molecular formula C5H10F2N2O and a molecular weight of 152.14 g/mol. Its IUPAC name is 2,2-difluoro-N-methyl-3-(methylamino)propanamide.

Molecular Properties

Compound Name2,2-difluoro-N-methyl-3-(methylamino)propanamide
PubChem CID14093529
Molecular FormulaC5H10F2N2O
Molecular Weight152.14 g/mol
Exact Mass152.08
IUPAC Name2,2-difluoro-N-methyl-3-(methylamino)propanamide
SMILESCNCC(F)(F)C(=O)NC
InChIInChI=1S/C5H10F2N2O/c1-8-3-5(6,7)4(10)9-2/h8H,3H2,1-2H3,(H,9,10)
InChIKeyZKSPWIIWWQWXTF-UHFFFAOYSA-N
XLogP-0.41
TPSA41.13 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms10
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500152.14
LogP ≤ 5-0.41
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 2,2-difluoro-N-methyl-3-(methylamino)propanamide?
The IUPAC name of 2,2-difluoro-N-methyl-3-(methylamino)propanamide (CID 14093529) is 2,2-difluoro-N-methyl-3-(methylamino)propanamide.
What is the SMILES notation for 2,2-difluoro-N-methyl-3-(methylamino)propanamide?
The canonical SMILES for 2,2-difluoro-N-methyl-3-(methylamino)propanamide is CNCC(F)(F)C(=O)NC.
What is the InChIKey of 2,2-difluoro-N-methyl-3-(methylamino)propanamide?
The InChIKey is ZKSPWIIWWQWXTF-UHFFFAOYSA-N. The full InChI is InChI=1S/C5H10F2N2O/c1-8-3-5(6,7)4(10)9-2/h8H,3H2,1-2H3,(H,9,10).
What are the key properties of 2,2-difluoro-N-methyl-3-(methylamino)propanamide?
2,2-difluoro-N-methyl-3-(methylamino)propanamide has a molecular weight of 152.14 g/mol, XLogP of -0.41, 3 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2,2-difluoro-N-methyl-3-(methylamino)propanamide is sourced from PubChem (CID 14093529), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).