(3Z)-N-ethenyl-3-ethylidene-1-methylpyrrolidin-2-imine

C9H14N2 — CID 138667496

IUPAC(3Z)-N-ethenyl-3-ethylidene-1-methylpyrrolidin-2-imine
SMILESC=C/N=C1C(=C\C)/CCN/1C
InChIInChI=1S/C9H14N2/c1-4-8-6-7-11(3)9(8)10-5-2/h4-5H,2,6-7H2,1,3H3/b8-4-,10-9-
InChIKeyMSODOXKTQIXCLW-LSTBLOBISA-N
MW150.22 g/mol
LogP1.81
Rot. Bonds1

About (3Z)-N-ethenyl-3-ethylidene-1-methylpyrrolidin-2-imine

(3Z)-N-ethenyl-3-ethylidene-1-methylpyrrolidin-2-imine (PubChem CID 138667496) has the molecular formula C9H14N2 and a molecular weight of 150.22 g/mol. Its IUPAC name is (3Z)-N-ethenyl-3-ethylidene-1-methylpyrrolidin-2-imine.

Molecular Properties

Compound Name(3Z)-N-ethenyl-3-ethylidene-1-methylpyrrolidin-2-imine
PubChem CID138667496
Molecular FormulaC9H14N2
Molecular Weight150.22 g/mol
Exact Mass150.12
IUPAC Name(3Z)-N-ethenyl-3-ethylidene-1-methylpyrrolidin-2-imine
SMILESC=C/N=C1C(=C\C)/CCN/1C
InChIInChI=1S/C9H14N2/c1-4-8-6-7-11(3)9(8)10-5-2/h4-5H,2,6-7H2,1,3H3/b8-4-,10-9-
InChIKeyMSODOXKTQIXCLW-LSTBLOBISA-N
XLogP1.81
TPSA15.60 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds1
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500150.22
LogP ≤ 51.81
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-ethenyl-3-ethylidene-1-methylpyrrolidin-2-imine?
The IUPAC name of (3Z)-N-ethenyl-3-ethylidene-1-methylpyrrolidin-2-imine (CID 138667496) is (3Z)-N-ethenyl-3-ethylidene-1-methylpyrrolidin-2-imine.
What is the SMILES notation for (3Z)-N-ethenyl-3-ethylidene-1-methylpyrrolidin-2-imine?
The canonical SMILES for (3Z)-N-ethenyl-3-ethylidene-1-methylpyrrolidin-2-imine is C=C/N=C1C(=C\C)/CCN/1C.
What is the InChIKey of (3Z)-N-ethenyl-3-ethylidene-1-methylpyrrolidin-2-imine?
The InChIKey is MSODOXKTQIXCLW-LSTBLOBISA-N. The full InChI is InChI=1S/C9H14N2/c1-4-8-6-7-11(3)9(8)10-5-2/h4-5H,2,6-7H2,1,3H3/b8-4-,10-9-.
What are the key properties of (3Z)-N-ethenyl-3-ethylidene-1-methylpyrrolidin-2-imine?
(3Z)-N-ethenyl-3-ethylidene-1-methylpyrrolidin-2-imine has a molecular weight of 150.22 g/mol, XLogP of 1.81, 1 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for (3Z)-N-ethenyl-3-ethylidene-1-methylpyrrolidin-2-imine is sourced from PubChem (CID 138667496), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).