(Z)-N'-(1-fluoroethyl)-N,N'-dimethylethene-1,2-diamine

C6H13FN2 — CID 146384643

IUPAC(Z)-N'-(1-fluoroethyl)-N,N'-dimethylethene-1,2-diamine
SMILESCN/C=C\N(C)C(C)F
InChIInChI=1S/C6H13FN2/c1-6(7)9(3)5-4-8-2/h4-6,8H,1-3H3/b5-4-
InChIKeyFGQKOFWABPPVML-PLNGDYQASA-N
MW132.18 g/mol
LogP0.92
Rot. Bonds3

About (Z)-N'-(1-fluoroethyl)-N,N'-dimethylethene-1,2-diamine

(Z)-N'-(1-fluoroethyl)-N,N'-dimethylethene-1,2-diamine (PubChem CID 146384643) has the molecular formula C6H13FN2 and a molecular weight of 132.18 g/mol. Its IUPAC name is (Z)-N'-(1-fluoroethyl)-N,N'-dimethylethene-1,2-diamine.

Molecular Properties

Compound Name(Z)-N'-(1-fluoroethyl)-N,N'-dimethylethene-1,2-diamine
PubChem CID146384643
Molecular FormulaC6H13FN2
Molecular Weight132.18 g/mol
Exact Mass132.11
IUPAC Name(Z)-N'-(1-fluoroethyl)-N,N'-dimethylethene-1,2-diamine
SMILESCN/C=C\N(C)C(C)F
InChIInChI=1S/C6H13FN2/c1-6(7)9(3)5-4-8-2/h4-6,8H,1-3H3/b5-4-
InChIKeyFGQKOFWABPPVML-PLNGDYQASA-N
XLogP0.92
TPSA15.27 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms9
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500132.18
LogP ≤ 50.92
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'N-C-halo', 'substructure': 'N/A'}

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Frequently Asked Questions

What is the IUPAC name of (Z)-N'-(1-fluoroethyl)-N,N'-dimethylethene-1,2-diamine?
The IUPAC name of (Z)-N'-(1-fluoroethyl)-N,N'-dimethylethene-1,2-diamine (CID 146384643) is (Z)-N'-(1-fluoroethyl)-N,N'-dimethylethene-1,2-diamine.
What is the SMILES notation for (Z)-N'-(1-fluoroethyl)-N,N'-dimethylethene-1,2-diamine?
The canonical SMILES for (Z)-N'-(1-fluoroethyl)-N,N'-dimethylethene-1,2-diamine is CN/C=C\N(C)C(C)F.
What is the InChIKey of (Z)-N'-(1-fluoroethyl)-N,N'-dimethylethene-1,2-diamine?
The InChIKey is FGQKOFWABPPVML-PLNGDYQASA-N. The full InChI is InChI=1S/C6H13FN2/c1-6(7)9(3)5-4-8-2/h4-6,8H,1-3H3/b5-4-.
What are the key properties of (Z)-N'-(1-fluoroethyl)-N,N'-dimethylethene-1,2-diamine?
(Z)-N'-(1-fluoroethyl)-N,N'-dimethylethene-1,2-diamine has a molecular weight of 132.18 g/mol, XLogP of 0.92, 3 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for (Z)-N'-(1-fluoroethyl)-N,N'-dimethylethene-1,2-diamine is sourced from PubChem (CID 146384643), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).