(E)-N-ethyl-2-fluoro-N-methylbut-2-en-1-amine

C7H14FN — CID 146384574

IUPAC(E)-N-ethyl-2-fluoro-N-methylbut-2-en-1-amine
SMILESC/C=C(/F)CN(C)CC
InChIInChI=1S/C7H14FN/c1-4-7(8)6-9(3)5-2/h4H,5-6H2,1-3H3/b7-4+
InChIKeyQLZOZEIHTXJXRG-QPJJXVBHSA-N
MW131.19 g/mol
LogP1.81
Rot. Bonds3

About (E)-N-ethyl-2-fluoro-N-methylbut-2-en-1-amine

(E)-N-ethyl-2-fluoro-N-methylbut-2-en-1-amine (PubChem CID 146384574) has the molecular formula C7H14FN and a molecular weight of 131.19 g/mol. Its IUPAC name is (E)-N-ethyl-2-fluoro-N-methylbut-2-en-1-amine.

Molecular Properties

Compound Name(E)-N-ethyl-2-fluoro-N-methylbut-2-en-1-amine
PubChem CID146384574
Molecular FormulaC7H14FN
Molecular Weight131.19 g/mol
Exact Mass131.11
IUPAC Name(E)-N-ethyl-2-fluoro-N-methylbut-2-en-1-amine
SMILESC/C=C(/F)CN(C)CC
InChIInChI=1S/C7H14FN/c1-4-7(8)6-9(3)5-2/h4H,5-6H2,1-3H3/b7-4+
InChIKeyQLZOZEIHTXJXRG-QPJJXVBHSA-N
XLogP1.81
TPSA3.24 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds3
Heavy Atoms9
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500131.19
LogP ≤ 51.81
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

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Related Compounds

Diallylmethylamine
CID 75501
2-Propen-1-amine, N,N-diethyl-
CID 79748
2,5-Dihydro-1-methylpyrrole
CID 136355
N-Ethyl-N-methyl-2-propen-1-amine
CID 558363
1-(3-fluoropropyl)-2,5-dihydro-1H-pyrrole
CID 145874744
N-(3,3-difluoroallyl)-diethylamine
CID 129878552
[(2e)-But-2-enyl]dimethylamine
CID 12256619
1,1-Dimethyl-2,5-dihydropyrrol-1-ium
CID 19037197
N,N-dimethyl-2-butenyl-amine
CID 53420268
N-ethyl-2-fluoro-N-methylprop-2-en-1-amine
CID 59154992
N-ethyl-3,3-difluoro-N-methylprop-2-en-1-amine
CID 59155105
1-(2-Fluoroethyl)-3-methyl-2,5-dihydropyrrole
CID 88589108

Frequently Asked Questions

What is the IUPAC name of (E)-N-ethyl-2-fluoro-N-methylbut-2-en-1-amine?
The IUPAC name of (E)-N-ethyl-2-fluoro-N-methylbut-2-en-1-amine (CID 146384574) is (E)-N-ethyl-2-fluoro-N-methylbut-2-en-1-amine.
What is the SMILES notation for (E)-N-ethyl-2-fluoro-N-methylbut-2-en-1-amine?
The canonical SMILES for (E)-N-ethyl-2-fluoro-N-methylbut-2-en-1-amine is C/C=C(/F)CN(C)CC.
What is the InChIKey of (E)-N-ethyl-2-fluoro-N-methylbut-2-en-1-amine?
The InChIKey is QLZOZEIHTXJXRG-QPJJXVBHSA-N. The full InChI is InChI=1S/C7H14FN/c1-4-7(8)6-9(3)5-2/h4H,5-6H2,1-3H3/b7-4+.
What are the key properties of (E)-N-ethyl-2-fluoro-N-methylbut-2-en-1-amine?
(E)-N-ethyl-2-fluoro-N-methylbut-2-en-1-amine has a molecular weight of 131.19 g/mol, XLogP of 1.81, 3 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for (E)-N-ethyl-2-fluoro-N-methylbut-2-en-1-amine is sourced from PubChem (CID 146384574), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).