N-ethyl-3,3-difluoro-N-methylprop-2-en-1-amine

C6H11F2N — CID 59155105

IUPACN-ethyl-3,3-difluoro-N-methylprop-2-en-1-amine
SMILESCCN(C)CC=C(F)F
InChIInChI=1S/C6H11F2N/c1-3-9(2)5-4-6(7)8/h4H,3,5H2,1-2H3
InChIKeyBASLXDJIKHDBAY-UHFFFAOYSA-N
MW135.16 g/mol
LogP1.72
Rot. Bonds3

About N-ethyl-3,3-difluoro-N-methylprop-2-en-1-amine

N-ethyl-3,3-difluoro-N-methylprop-2-en-1-amine (PubChem CID 59155105) has the molecular formula C6H11F2N and a molecular weight of 135.16 g/mol. Its IUPAC name is N-ethyl-3,3-difluoro-N-methylprop-2-en-1-amine.

Molecular Properties

Compound NameN-ethyl-3,3-difluoro-N-methylprop-2-en-1-amine
PubChem CID59155105
Molecular FormulaC6H11F2N
Molecular Weight135.16 g/mol
Exact Mass135.09
IUPAC NameN-ethyl-3,3-difluoro-N-methylprop-2-en-1-amine
SMILESCCN(C)CC=C(F)F
InChIInChI=1S/C6H11F2N/c1-3-9(2)5-4-6(7)8/h4H,3,5H2,1-2H3
InChIKeyBASLXDJIKHDBAY-UHFFFAOYSA-N
XLogP1.72
TPSA3.24 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds3
Heavy Atoms9
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500135.16
LogP ≤ 51.72
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

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Related Compounds

N-(3,3-difluoroallyl)-diethylamine
CID 129878552
N,N-diethyl-1,1,2,3,3-pentafluoroprop-2-en-1-amine
CID 53793193
N-methyl-N-(trifluoromethyl)prop-2-en-1-amine
CID 58019336
N-ethyl-2-fluoro-N-methylprop-2-en-1-amine
CID 59154992
N-prop-2-enyl-N-(trifluoromethyl)prop-2-en-1-amine
CID 88598252
1,1-difluoro-N,N-dimethylprop-2-en-1-amine
CID 121361161
1,2-difluoro-N,N-dimethylprop-2-en-1-amine
CID 129207811
N-(2,2-difluoroethyl)-N-methylprop-2-en-1-amine
CID 130670085
N-(2-fluoroethyl)-N-methylprop-2-en-1-amine
CID 131108623
trimethyl-[(Z)-3,4,4-trifluorobut-2-enyl]azanium
CID 135270741
N,N-bis(2,2,2-trifluoroethyl)prop-2-en-1-amine
CID 140552329
2,4-difluoro-N,N-dimethylpenta-2,3-dien-1-amine
CID 142802248

Frequently Asked Questions

What is the IUPAC name of N-ethyl-3,3-difluoro-N-methylprop-2-en-1-amine?
The IUPAC name of N-ethyl-3,3-difluoro-N-methylprop-2-en-1-amine (CID 59155105) is N-ethyl-3,3-difluoro-N-methylprop-2-en-1-amine.
What is the SMILES notation for N-ethyl-3,3-difluoro-N-methylprop-2-en-1-amine?
The canonical SMILES for N-ethyl-3,3-difluoro-N-methylprop-2-en-1-amine is CCN(C)CC=C(F)F.
What is the InChIKey of N-ethyl-3,3-difluoro-N-methylprop-2-en-1-amine?
The InChIKey is BASLXDJIKHDBAY-UHFFFAOYSA-N. The full InChI is InChI=1S/C6H11F2N/c1-3-9(2)5-4-6(7)8/h4H,3,5H2,1-2H3.
What are the key properties of N-ethyl-3,3-difluoro-N-methylprop-2-en-1-amine?
N-ethyl-3,3-difluoro-N-methylprop-2-en-1-amine has a molecular weight of 135.16 g/mol, XLogP of 1.72, 3 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for N-ethyl-3,3-difluoro-N-methylprop-2-en-1-amine is sourced from PubChem (CID 59155105), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).