(E)-N'-(2,2-difluoroethyl)ethene-1,2-diamine

C4H8F2N2 — CID 145229980

IUPAC(E)-N'-(2,2-difluoroethyl)ethene-1,2-diamine
SMILESN/C=C/NCC(F)F
InChIInChI=1S/C4H8F2N2/c5-4(6)3-8-2-1-7/h1-2,4,8H,3,7H2/b2-1+
InChIKeyVSSDMSHLLOONSZ-OWOJBTEDSA-N
MW122.12 g/mol
LogP0.27
Rot. Bonds3

About (E)-N'-(2,2-difluoroethyl)ethene-1,2-diamine

(E)-N'-(2,2-difluoroethyl)ethene-1,2-diamine (PubChem CID 145229980) has the molecular formula C4H8F2N2 and a molecular weight of 122.12 g/mol. Its IUPAC name is (E)-N'-(2,2-difluoroethyl)ethene-1,2-diamine.

Molecular Properties

Compound Name(E)-N'-(2,2-difluoroethyl)ethene-1,2-diamine
PubChem CID145229980
Molecular FormulaC4H8F2N2
Molecular Weight122.12 g/mol
Exact Mass122.07
IUPAC Name(E)-N'-(2,2-difluoroethyl)ethene-1,2-diamine
SMILESN/C=C/NCC(F)F
InChIInChI=1S/C4H8F2N2/c5-4(6)3-8-2-1-7/h1-2,4,8H,3,7H2/b2-1+
InChIKeyVSSDMSHLLOONSZ-OWOJBTEDSA-N
XLogP0.27
TPSA38.05 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms8
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500122.12
LogP ≤ 50.27
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Related Compounds

N-ethenyl-2,2,2-trifluoroethanamine
CID 131575085
N-(trifluoromethyl)ethenamine
CID 142975971
N-ethenyl-1,1,1-trifluoropropan-2-amine
CID 146650829
(E)-2-fluoro-N-[(E)-2-fluoroethenyl]ethenamine
CID 156663393
2-fluoro-N-(2-fluoroethenyl)ethenamine
CID 158118050
(2S)-N-ethenyl-1,1,1-trifluoropropan-2-amine
CID 163886842
(Z)-N'-ethyl-N-methyl-N'-(trifluoromethylsulfanyl)ethene-1,2-diamine
CID 170369254
4-(difluoromethyl)-1H-pyrazine
CID 173747805
N-ethenyl-1,2,2-trifluoroethanamine
CID 175559672
N-ethenyl-2,2,2-trifluoroethanamine;hydrochloride
CID 176890209
(E)-N-ethyl-3,3,3-trifluoroprop-1-en-1-amine
CID 14066876
N-ethenyl-2-fluoroethanamine
CID 142813408

Frequently Asked Questions

What is the IUPAC name of (E)-N'-(2,2-difluoroethyl)ethene-1,2-diamine?
The IUPAC name of (E)-N'-(2,2-difluoroethyl)ethene-1,2-diamine (CID 145229980) is (E)-N'-(2,2-difluoroethyl)ethene-1,2-diamine.
What is the SMILES notation for (E)-N'-(2,2-difluoroethyl)ethene-1,2-diamine?
The canonical SMILES for (E)-N'-(2,2-difluoroethyl)ethene-1,2-diamine is N/C=C/NCC(F)F.
What is the InChIKey of (E)-N'-(2,2-difluoroethyl)ethene-1,2-diamine?
The InChIKey is VSSDMSHLLOONSZ-OWOJBTEDSA-N. The full InChI is InChI=1S/C4H8F2N2/c5-4(6)3-8-2-1-7/h1-2,4,8H,3,7H2/b2-1+.
What are the key properties of (E)-N'-(2,2-difluoroethyl)ethene-1,2-diamine?
(E)-N'-(2,2-difluoroethyl)ethene-1,2-diamine has a molecular weight of 122.12 g/mol, XLogP of 0.27, 3 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for (E)-N'-(2,2-difluoroethyl)ethene-1,2-diamine is sourced from PubChem (CID 145229980), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).