N-(2,2-difluoroethyl)-2,2-difluoroethanamine

C4H7F4N — CID 23323251

IUPACN-(2,2-difluoroethyl)-2,2-difluoroethanamine
SMILESFC(F)CNCC(F)F
InChIInChI=1S/C4H7F4N/c5-3(6)1-9-2-4(7)8/h3-4,9H,1-2H2
InChIKeyFJPCRAPMCMURRO-UHFFFAOYSA-N
MW145.10 g/mol
LogP1.11
Rot. Bonds4

About N-(2,2-difluoroethyl)-2,2-difluoroethanamine

N-(2,2-difluoroethyl)-2,2-difluoroethanamine (PubChem CID 23323251) has the molecular formula C4H7F4N and a molecular weight of 145.10 g/mol. Its IUPAC name is N-(2,2-difluoroethyl)-2,2-difluoroethanamine.

Molecular Properties

Compound NameN-(2,2-difluoroethyl)-2,2-difluoroethanamine
PubChem CID23323251
Molecular FormulaC4H7F4N
Molecular Weight145.10 g/mol
Exact Mass145.05
IUPAC NameN-(2,2-difluoroethyl)-2,2-difluoroethanamine
SMILESFC(F)CNCC(F)F
InChIInChI=1S/C4H7F4N/c5-3(6)1-9-2-4(7)8/h3-4,9H,1-2H2
InChIKeyFJPCRAPMCMURRO-UHFFFAOYSA-N
XLogP1.11
TPSA12.03 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds4
Heavy Atoms9
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500145.10
LogP ≤ 51.11
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

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Frequently Asked Questions

What is the IUPAC name of N-(2,2-difluoroethyl)-2,2-difluoroethanamine?
The IUPAC name of N-(2,2-difluoroethyl)-2,2-difluoroethanamine (CID 23323251) is N-(2,2-difluoroethyl)-2,2-difluoroethanamine.
What is the SMILES notation for N-(2,2-difluoroethyl)-2,2-difluoroethanamine?
The canonical SMILES for N-(2,2-difluoroethyl)-2,2-difluoroethanamine is FC(F)CNCC(F)F.
What is the InChIKey of N-(2,2-difluoroethyl)-2,2-difluoroethanamine?
The InChIKey is FJPCRAPMCMURRO-UHFFFAOYSA-N. The full InChI is InChI=1S/C4H7F4N/c5-3(6)1-9-2-4(7)8/h3-4,9H,1-2H2.
What are the key properties of N-(2,2-difluoroethyl)-2,2-difluoroethanamine?
N-(2,2-difluoroethyl)-2,2-difluoroethanamine has a molecular weight of 145.10 g/mol, XLogP of 1.11, 4 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2,2-difluoroethyl)-2,2-difluoroethanamine is sourced from PubChem (CID 23323251), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).