(Z)-N-(1-fluoroethyl)-N-methylbut-2-en-2-amine

C7H14FN — CID 167142859

IUPAC(Z)-N-(1-fluoroethyl)-N-methylbut-2-en-2-amine
SMILESC/C=C(/C)N(C)C(C)F
InChIInChI=1S/C7H14FN/c1-5-6(2)9(4)7(3)8/h5,7H,1-4H3/b6-5-
InChIKeyGIDVNMGECINUEW-WAYWQWQTSA-N
MW131.19 g/mol
LogP2.16
Rot. Bonds2

About (Z)-N-(1-fluoroethyl)-N-methylbut-2-en-2-amine

(Z)-N-(1-fluoroethyl)-N-methylbut-2-en-2-amine (PubChem CID 167142859) has the molecular formula C7H14FN and a molecular weight of 131.19 g/mol. Its IUPAC name is (Z)-N-(1-fluoroethyl)-N-methylbut-2-en-2-amine.

Molecular Properties

Compound Name(Z)-N-(1-fluoroethyl)-N-methylbut-2-en-2-amine
PubChem CID167142859
Molecular FormulaC7H14FN
Molecular Weight131.19 g/mol
Exact Mass131.11
IUPAC Name(Z)-N-(1-fluoroethyl)-N-methylbut-2-en-2-amine
SMILESC/C=C(/C)N(C)C(C)F
InChIInChI=1S/C7H14FN/c1-5-6(2)9(4)7(3)8/h5,7H,1-4H3/b6-5-
InChIKeyGIDVNMGECINUEW-WAYWQWQTSA-N
XLogP2.16
TPSA3.24 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds2
Heavy Atoms9
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500131.19
LogP ≤ 52.16
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

Computed Properties (RDKit)

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

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Related Compounds

(Z)-N,N-diethyl-1-fluoroprop-1-en-1-amine
CID 134986396
(E)-N,N-dimethylbut-2-en-2-amine
CID 6916002
(E)-4,4,4-trifluoro-N,N-dimethylbut-2-en-2-amine
CID 129271803
3-fluoro-1,6-dimethyl-2H-pyridine
CID 145003766
N-(2-fluoroethyl)-N-(fluoromethyl)prop-1-en-2-amine
CID 146292682
(E)-1-fluoro-N-methyl-N-prop-1-en-2-ylprop-1-en-1-amine
CID 146392901
N,N-bis(2-fluoroethyl)prop-1-en-2-amine
CID 163258122
(Z)-2-fluoro-N-methyl-N-prop-1-en-2-ylprop-1-en-1-amine
CID 163483687
N-[(1R)-1-fluoroethyl]-N-methylprop-1-en-2-amine
CID 163860747
(Z)-N-methyl-N-(2,2,2-trifluoroethyl)but-2-en-2-amine
CID 167287848
(Z)-N-propan-2-yl-N-(trifluoromethyl)but-2-en-2-amine
CID 170040571
N-methyl-N-(2,2,2-trifluoroethyl)but-2-en-2-amine
CID 174100546

Frequently Asked Questions

What is the IUPAC name of (Z)-N-(1-fluoroethyl)-N-methylbut-2-en-2-amine?
The IUPAC name of (Z)-N-(1-fluoroethyl)-N-methylbut-2-en-2-amine (CID 167142859) is (Z)-N-(1-fluoroethyl)-N-methylbut-2-en-2-amine.
What is the SMILES notation for (Z)-N-(1-fluoroethyl)-N-methylbut-2-en-2-amine?
The canonical SMILES for (Z)-N-(1-fluoroethyl)-N-methylbut-2-en-2-amine is C/C=C(/C)N(C)C(C)F.
What is the InChIKey of (Z)-N-(1-fluoroethyl)-N-methylbut-2-en-2-amine?
The InChIKey is GIDVNMGECINUEW-WAYWQWQTSA-N. The full InChI is InChI=1S/C7H14FN/c1-5-6(2)9(4)7(3)8/h5,7H,1-4H3/b6-5-.
What are the key properties of (Z)-N-(1-fluoroethyl)-N-methylbut-2-en-2-amine?
(Z)-N-(1-fluoroethyl)-N-methylbut-2-en-2-amine has a molecular weight of 131.19 g/mol, XLogP of 2.16, 2 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for (Z)-N-(1-fluoroethyl)-N-methylbut-2-en-2-amine is sourced from PubChem (CID 167142859), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).