3,3-difluoro-N,N-dimethylprop-1-en-1-amine

C5H9F2N — CID 173037848

IUPAC3,3-difluoro-N,N-dimethylprop-1-en-1-amine
SMILESCN(C)C=CC(F)F
InChIInChI=1S/C5H9F2N/c1-8(2)4-3-5(6)7/h3-5H,1-2H3
InChIKeyFDGXLIMINOMASY-UHFFFAOYSA-N
MW121.13 g/mol
LogP1.33
Rot. Bonds2

About 3,3-difluoro-N,N-dimethylprop-1-en-1-amine

3,3-difluoro-N,N-dimethylprop-1-en-1-amine (PubChem CID 173037848) has the molecular formula C5H9F2N and a molecular weight of 121.13 g/mol. Its IUPAC name is 3,3-difluoro-N,N-dimethylprop-1-en-1-amine.

Molecular Properties

Compound Name3,3-difluoro-N,N-dimethylprop-1-en-1-amine
PubChem CID173037848
Molecular FormulaC5H9F2N
Molecular Weight121.13 g/mol
Exact Mass121.07
IUPAC Name3,3-difluoro-N,N-dimethylprop-1-en-1-amine
SMILESCN(C)C=CC(F)F
InChIInChI=1S/C5H9F2N/c1-8(2)4-3-5(6)7/h3-5H,1-2H3
InChIKeyFDGXLIMINOMASY-UHFFFAOYSA-N
XLogP1.33
TPSA3.24 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds2
Heavy Atoms8
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500121.13
LogP ≤ 51.33
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

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Frequently Asked Questions

What is the IUPAC name of 3,3-difluoro-N,N-dimethylprop-1-en-1-amine?
The IUPAC name of 3,3-difluoro-N,N-dimethylprop-1-en-1-amine (CID 173037848) is 3,3-difluoro-N,N-dimethylprop-1-en-1-amine.
What is the SMILES notation for 3,3-difluoro-N,N-dimethylprop-1-en-1-amine?
The canonical SMILES for 3,3-difluoro-N,N-dimethylprop-1-en-1-amine is CN(C)C=CC(F)F.
What is the InChIKey of 3,3-difluoro-N,N-dimethylprop-1-en-1-amine?
The InChIKey is FDGXLIMINOMASY-UHFFFAOYSA-N. The full InChI is InChI=1S/C5H9F2N/c1-8(2)4-3-5(6)7/h3-5H,1-2H3.
What are the key properties of 3,3-difluoro-N,N-dimethylprop-1-en-1-amine?
3,3-difluoro-N,N-dimethylprop-1-en-1-amine has a molecular weight of 121.13 g/mol, XLogP of 1.33, 2 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 3,3-difluoro-N,N-dimethylprop-1-en-1-amine is sourced from PubChem (CID 173037848), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).