(Z)-N-(4-fluoro-5-methyl-2-methylidene-1-pyridinyl)ethanimine

C9H11FN2 — CID 166858571

IUPAC(Z)-N-(4-fluoro-5-methyl-2-methylidene-1-pyridinyl)ethanimine
SMILESC=C1C=C(F)C(C)=CN1/N=C\C
InChIInChI=1S/C9H11FN2/c1-4-11-12-6-7(2)9(10)5-8(12)3/h4-6H,3H2,1-2H3/b11-4-
InChIKeyBZKACLOHGWRYFB-WCIBSUBMSA-N
MW166.20 g/mol
LogP2.58
Rot. Bonds1

About (Z)-N-(4-fluoro-5-methyl-2-methylidene-1-pyridinyl)ethanimine

(Z)-N-(4-fluoro-5-methyl-2-methylidene-1-pyridinyl)ethanimine (PubChem CID 166858571) has the molecular formula C9H11FN2 and a molecular weight of 166.20 g/mol. Its IUPAC name is (Z)-N-(4-fluoro-5-methyl-2-methylidene-1-pyridinyl)ethanimine.

Molecular Properties

Compound Name(Z)-N-(4-fluoro-5-methyl-2-methylidene-1-pyridinyl)ethanimine
PubChem CID166858571
Molecular FormulaC9H11FN2
Molecular Weight166.20 g/mol
Exact Mass166.09
IUPAC Name(Z)-N-(4-fluoro-5-methyl-2-methylidene-1-pyridinyl)ethanimine
SMILESC=C1C=C(F)C(C)=CN1/N=C\C
InChIInChI=1S/C9H11FN2/c1-4-11-12-6-7(2)9(10)5-8(12)3/h4-6H,3H2,1-2H3/b11-4-
InChIKeyBZKACLOHGWRYFB-WCIBSUBMSA-N
XLogP2.58
TPSA15.60 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds1
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500166.20
LogP ≤ 52.58
H-Bond Donors ≤ 50
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)-N-(4-fluoro-5-methyl-2-methylidene-1-pyridinyl)ethanimine?
The IUPAC name of (Z)-N-(4-fluoro-5-methyl-2-methylidene-1-pyridinyl)ethanimine (CID 166858571) is (Z)-N-(4-fluoro-5-methyl-2-methylidene-1-pyridinyl)ethanimine.
What is the SMILES notation for (Z)-N-(4-fluoro-5-methyl-2-methylidene-1-pyridinyl)ethanimine?
The canonical SMILES for (Z)-N-(4-fluoro-5-methyl-2-methylidene-1-pyridinyl)ethanimine is C=C1C=C(F)C(C)=CN1/N=C\C.
What is the InChIKey of (Z)-N-(4-fluoro-5-methyl-2-methylidene-1-pyridinyl)ethanimine?
The InChIKey is BZKACLOHGWRYFB-WCIBSUBMSA-N. The full InChI is InChI=1S/C9H11FN2/c1-4-11-12-6-7(2)9(10)5-8(12)3/h4-6H,3H2,1-2H3/b11-4-.
What are the key properties of (Z)-N-(4-fluoro-5-methyl-2-methylidene-1-pyridinyl)ethanimine?
(Z)-N-(4-fluoro-5-methyl-2-methylidene-1-pyridinyl)ethanimine has a molecular weight of 166.20 g/mol, XLogP of 2.58, 1 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for (Z)-N-(4-fluoro-5-methyl-2-methylidene-1-pyridinyl)ethanimine is sourced from PubChem (CID 166858571), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).