1-methyl-4-methylidene-N-[(Z)-prop-1-enyl]pyrrolidin-3-imine

C9H14N2 — CID 143154278

IUPAC1-methyl-4-methylidene-N-[(Z)-prop-1-enyl]pyrrolidin-3-imine
SMILESC=C1CN(C)C/C1=N\C=C/C
InChIInChI=1S/C9H14N2/c1-4-5-10-9-7-11(3)6-8(9)2/h4-5H,2,6-7H2,1,3H3/b5-4-,10-9+
InChIKeyPMECGZMPEBBMOA-HJXNJETESA-N
MW150.22 g/mol
LogP1.46
Rot. Bonds1

About 1-methyl-4-methylidene-N-[(Z)-prop-1-enyl]pyrrolidin-3-imine

1-methyl-4-methylidene-N-[(Z)-prop-1-enyl]pyrrolidin-3-imine (PubChem CID 143154278) has the molecular formula C9H14N2 and a molecular weight of 150.22 g/mol. Its IUPAC name is 1-methyl-4-methylidene-N-[(Z)-prop-1-enyl]pyrrolidin-3-imine.

Molecular Properties

Compound Name1-methyl-4-methylidene-N-[(Z)-prop-1-enyl]pyrrolidin-3-imine
PubChem CID143154278
Molecular FormulaC9H14N2
Molecular Weight150.22 g/mol
Exact Mass150.12
IUPAC Name1-methyl-4-methylidene-N-[(Z)-prop-1-enyl]pyrrolidin-3-imine
SMILESC=C1CN(C)C/C1=N\C=C/C
InChIInChI=1S/C9H14N2/c1-4-5-10-9-7-11(3)6-8(9)2/h4-5H,2,6-7H2,1,3H3/b5-4-,10-9+
InChIKeyPMECGZMPEBBMOA-HJXNJETESA-N
XLogP1.46
TPSA15.60 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds1
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500150.22
LogP ≤ 51.46
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 1-methyl-4-methylidene-N-[(Z)-prop-1-enyl]pyrrolidin-3-imine?
The IUPAC name of 1-methyl-4-methylidene-N-[(Z)-prop-1-enyl]pyrrolidin-3-imine (CID 143154278) is 1-methyl-4-methylidene-N-[(Z)-prop-1-enyl]pyrrolidin-3-imine.
What is the SMILES notation for 1-methyl-4-methylidene-N-[(Z)-prop-1-enyl]pyrrolidin-3-imine?
The canonical SMILES for 1-methyl-4-methylidene-N-[(Z)-prop-1-enyl]pyrrolidin-3-imine is C=C1CN(C)C/C1=N\C=C/C.
What is the InChIKey of 1-methyl-4-methylidene-N-[(Z)-prop-1-enyl]pyrrolidin-3-imine?
The InChIKey is PMECGZMPEBBMOA-HJXNJETESA-N. The full InChI is InChI=1S/C9H14N2/c1-4-5-10-9-7-11(3)6-8(9)2/h4-5H,2,6-7H2,1,3H3/b5-4-,10-9+.
What are the key properties of 1-methyl-4-methylidene-N-[(Z)-prop-1-enyl]pyrrolidin-3-imine?
1-methyl-4-methylidene-N-[(Z)-prop-1-enyl]pyrrolidin-3-imine has a molecular weight of 150.22 g/mol, XLogP of 1.46, 1 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 1-methyl-4-methylidene-N-[(Z)-prop-1-enyl]pyrrolidin-3-imine is sourced from PubChem (CID 143154278), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).