(3Z)-N-methyl-3-prop-2-enylidenepyridin-2-imine

C9H10N2 — CID 142845486

IUPAC(3Z)-N-methyl-3-prop-2-enylidenepyridin-2-imine
SMILESC=C/C=C1/C=CC=N/C1=N\C
InChIInChI=1S/C9H10N2/c1-3-5-8-6-4-7-11-9(8)10-2/h3-7H,1H2,2H3/b8-5-,10-9-
InChIKeyWDLIOPSIMOHHFU-IVXNCWGASA-N
MW146.19 g/mol
LogP1.77
Rot. Bonds1

About (3Z)-N-methyl-3-prop-2-enylidenepyridin-2-imine

(3Z)-N-methyl-3-prop-2-enylidenepyridin-2-imine (PubChem CID 142845486) has the molecular formula C9H10N2 and a molecular weight of 146.19 g/mol. Its IUPAC name is (3Z)-N-methyl-3-prop-2-enylidenepyridin-2-imine.

Molecular Properties

Compound Name(3Z)-N-methyl-3-prop-2-enylidenepyridin-2-imine
PubChem CID142845486
Molecular FormulaC9H10N2
Molecular Weight146.19 g/mol
Exact Mass146.08
IUPAC Name(3Z)-N-methyl-3-prop-2-enylidenepyridin-2-imine
SMILESC=C/C=C1/C=CC=N/C1=N\C
InChIInChI=1S/C9H10N2/c1-3-5-8-6-4-7-11-9(8)10-2/h3-7H,1H2,2H3/b8-5-,10-9-
InChIKeyWDLIOPSIMOHHFU-IVXNCWGASA-N
XLogP1.77
TPSA24.72 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds1
Heavy Atoms11
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500146.19
LogP ≤ 51.77
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

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 (3Z)-N-methyl-3-prop-2-enylidenepyridin-2-imine?
The IUPAC name of (3Z)-N-methyl-3-prop-2-enylidenepyridin-2-imine (CID 142845486) is (3Z)-N-methyl-3-prop-2-enylidenepyridin-2-imine.
What is the SMILES notation for (3Z)-N-methyl-3-prop-2-enylidenepyridin-2-imine?
The canonical SMILES for (3Z)-N-methyl-3-prop-2-enylidenepyridin-2-imine is C=C/C=C1/C=CC=N/C1=N\C.
What is the InChIKey of (3Z)-N-methyl-3-prop-2-enylidenepyridin-2-imine?
The InChIKey is WDLIOPSIMOHHFU-IVXNCWGASA-N. The full InChI is InChI=1S/C9H10N2/c1-3-5-8-6-4-7-11-9(8)10-2/h3-7H,1H2,2H3/b8-5-,10-9-.
What are the key properties of (3Z)-N-methyl-3-prop-2-enylidenepyridin-2-imine?
(3Z)-N-methyl-3-prop-2-enylidenepyridin-2-imine has a molecular weight of 146.19 g/mol, XLogP of 1.77, 1 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for (3Z)-N-methyl-3-prop-2-enylidenepyridin-2-imine is sourced from PubChem (CID 142845486), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).