(Z)-1-ethylimino-2-fluoropent-2-en-3-amine

C7H13FN2 — CID 89418430

IUPAC(Z)-1-ethylimino-2-fluoropent-2-en-3-amine
SMILESCC/N=C/C(F)=C(/N)CC
InChIInChI=1S/C7H13FN2/c1-3-7(9)6(8)5-10-4-2/h5H,3-4,9H2,1-2H3/b7-6-,10-5+
InChIKeyYJTRSTCGUOSRRG-JQEGGOPCSA-N
MW144.19 g/mol
LogP1.63
Rot. Bonds3

About (Z)-1-ethylimino-2-fluoropent-2-en-3-amine

(Z)-1-ethylimino-2-fluoropent-2-en-3-amine (PubChem CID 89418430) has the molecular formula C7H13FN2 and a molecular weight of 144.19 g/mol. Its IUPAC name is (Z)-1-ethylimino-2-fluoropent-2-en-3-amine.

Molecular Properties

Compound Name(Z)-1-ethylimino-2-fluoropent-2-en-3-amine
PubChem CID89418430
Molecular FormulaC7H13FN2
Molecular Weight144.19 g/mol
Exact Mass144.11
IUPAC Name(Z)-1-ethylimino-2-fluoropent-2-en-3-amine
SMILESCC/N=C/C(F)=C(/N)CC
InChIInChI=1S/C7H13FN2/c1-3-7(9)6(8)5-10-4-2/h5H,3-4,9H2,1-2H3/b7-6-,10-5+
InChIKeyYJTRSTCGUOSRRG-JQEGGOPCSA-N
XLogP1.63
TPSA38.38 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms10
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500144.19
LogP ≤ 51.63
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'imine_1', 'substructure': 'N/A'}

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Frequently Asked Questions

What is the IUPAC name of (Z)-1-ethylimino-2-fluoropent-2-en-3-amine?
The IUPAC name of (Z)-1-ethylimino-2-fluoropent-2-en-3-amine (CID 89418430) is (Z)-1-ethylimino-2-fluoropent-2-en-3-amine.
What is the SMILES notation for (Z)-1-ethylimino-2-fluoropent-2-en-3-amine?
The canonical SMILES for (Z)-1-ethylimino-2-fluoropent-2-en-3-amine is CC/N=C/C(F)=C(/N)CC.
What is the InChIKey of (Z)-1-ethylimino-2-fluoropent-2-en-3-amine?
The InChIKey is YJTRSTCGUOSRRG-JQEGGOPCSA-N. The full InChI is InChI=1S/C7H13FN2/c1-3-7(9)6(8)5-10-4-2/h5H,3-4,9H2,1-2H3/b7-6-,10-5+.
What are the key properties of (Z)-1-ethylimino-2-fluoropent-2-en-3-amine?
(Z)-1-ethylimino-2-fluoropent-2-en-3-amine has a molecular weight of 144.19 g/mol, XLogP of 1.63, 3 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for (Z)-1-ethylimino-2-fluoropent-2-en-3-amine is sourced from PubChem (CID 89418430), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).