1,1-difluoro-N,N-dimethylprop-1-en-2-amine

C5H9F2N — CID 134530504

IUPAC1,1-difluoro-N,N-dimethylprop-1-en-2-amine
SMILESCC(=C(F)F)N(C)C
InChIInChI=1S/C5H9F2N/c1-4(5(6)7)8(2)3/h1-3H3
InChIKeyQBIONRWNCCEKQW-UHFFFAOYSA-N
MW121.13 g/mol
LogP1.68
Rot. Bonds1

About 1,1-difluoro-N,N-dimethylprop-1-en-2-amine

1,1-difluoro-N,N-dimethylprop-1-en-2-amine (PubChem CID 134530504) has the molecular formula C5H9F2N and a molecular weight of 121.13 g/mol. Its IUPAC name is 1,1-difluoro-N,N-dimethylprop-1-en-2-amine.

Molecular Properties

Compound Name1,1-difluoro-N,N-dimethylprop-1-en-2-amine
PubChem CID134530504
Molecular FormulaC5H9F2N
Molecular Weight121.13 g/mol
Exact Mass121.07
IUPAC Name1,1-difluoro-N,N-dimethylprop-1-en-2-amine
SMILESCC(=C(F)F)N(C)C
InChIInChI=1S/C5H9F2N/c1-4(5(6)7)8(2)3/h1-3H3
InChIKeyQBIONRWNCCEKQW-UHFFFAOYSA-N
XLogP1.68
TPSA3.24 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds1
Heavy Atoms8
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500121.13
LogP ≤ 51.68
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

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Frequently Asked Questions

What is the IUPAC name of 1,1-difluoro-N,N-dimethylprop-1-en-2-amine?
The IUPAC name of 1,1-difluoro-N,N-dimethylprop-1-en-2-amine (CID 134530504) is 1,1-difluoro-N,N-dimethylprop-1-en-2-amine.
What is the SMILES notation for 1,1-difluoro-N,N-dimethylprop-1-en-2-amine?
The canonical SMILES for 1,1-difluoro-N,N-dimethylprop-1-en-2-amine is CC(=C(F)F)N(C)C.
What is the InChIKey of 1,1-difluoro-N,N-dimethylprop-1-en-2-amine?
The InChIKey is QBIONRWNCCEKQW-UHFFFAOYSA-N. The full InChI is InChI=1S/C5H9F2N/c1-4(5(6)7)8(2)3/h1-3H3.
What are the key properties of 1,1-difluoro-N,N-dimethylprop-1-en-2-amine?
1,1-difluoro-N,N-dimethylprop-1-en-2-amine has a molecular weight of 121.13 g/mol, XLogP of 1.68, 1 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 1,1-difluoro-N,N-dimethylprop-1-en-2-amine is sourced from PubChem (CID 134530504), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).