(E)-N,N-diethyl-3-fluoroprop-2-en-1-amine

C7H14FN — CID 143424278

IUPAC(E)-N,N-diethyl-3-fluoroprop-2-en-1-amine
SMILESCCN(CC)C/C=C/F
InChIInChI=1S/C7H14FN/c1-3-9(4-2)7-5-6-8/h5-6H,3-4,7H2,1-2H3/b6-5+
InChIKeyVZKILUPGYWCRPM-AATRIKPKSA-N
MW131.19 g/mol
LogP1.81
Rot. Bonds4

About (E)-N,N-diethyl-3-fluoroprop-2-en-1-amine

(E)-N,N-diethyl-3-fluoroprop-2-en-1-amine (PubChem CID 143424278) has the molecular formula C7H14FN and a molecular weight of 131.19 g/mol. Its IUPAC name is (E)-N,N-diethyl-3-fluoroprop-2-en-1-amine.

Molecular Properties

Compound Name(E)-N,N-diethyl-3-fluoroprop-2-en-1-amine
PubChem CID143424278
Molecular FormulaC7H14FN
Molecular Weight131.19 g/mol
Exact Mass131.11
IUPAC Name(E)-N,N-diethyl-3-fluoroprop-2-en-1-amine
SMILESCCN(CC)C/C=C/F
InChIInChI=1S/C7H14FN/c1-3-9(4-2)7-5-6-8/h5-6H,3-4,7H2,1-2H3/b6-5+
InChIKeyVZKILUPGYWCRPM-AATRIKPKSA-N
XLogP1.81
TPSA3.24 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds4
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

Triallylamine
CID 7617
Allyltrimethylammonium chloride
CID 15198
N,N-Dimethylallylamine
CID 75082
Diallylmethylamine
CID 75501
2-Propen-1-amine, N,N-diethyl-
CID 79748
2-Propen-1-aminium, N,N,N-trimethyl-, bromide (1:1)
CID 76358
2,5-Dihydro-1-methylpyrrole
CID 136355
Allyl-trimethyl-ammonium
CID 10425
N,N,N-Trimethylprop-2-en-1-aminium iodide
CID 26005
Dimethyldiallylammonium
CID 33287
N-Ethyl-N-methyl-2-propen-1-amine
CID 558363
1-(3-fluoropropyl)-2,5-dihydro-1H-pyrrole
CID 145874744

Frequently Asked Questions

What is the IUPAC name of (E)-N,N-diethyl-3-fluoroprop-2-en-1-amine?
The IUPAC name of (E)-N,N-diethyl-3-fluoroprop-2-en-1-amine (CID 143424278) is (E)-N,N-diethyl-3-fluoroprop-2-en-1-amine.
What is the SMILES notation for (E)-N,N-diethyl-3-fluoroprop-2-en-1-amine?
The canonical SMILES for (E)-N,N-diethyl-3-fluoroprop-2-en-1-amine is CCN(CC)C/C=C/F.
What is the InChIKey of (E)-N,N-diethyl-3-fluoroprop-2-en-1-amine?
The InChIKey is VZKILUPGYWCRPM-AATRIKPKSA-N. The full InChI is InChI=1S/C7H14FN/c1-3-9(4-2)7-5-6-8/h5-6H,3-4,7H2,1-2H3/b6-5+.
What are the key properties of (E)-N,N-diethyl-3-fluoroprop-2-en-1-amine?
(E)-N,N-diethyl-3-fluoroprop-2-en-1-amine has a molecular weight of 131.19 g/mol, XLogP of 1.81, 4 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for (E)-N,N-diethyl-3-fluoroprop-2-en-1-amine is sourced from PubChem (CID 143424278), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).