N-methyl-1-(2-methylidenepyrrolidin-1-yl)methanimine

C7H12N2 — CID 145316269

IUPACN-methyl-1-(2-methylidenepyrrolidin-1-yl)methanimine
SMILESC=C1CCCN1/C=N/C
InChIInChI=1S/C7H12N2/c1-7-4-3-5-9(7)6-8-2/h6H,1,3-5H2,2H3/b8-6+
InChIKeyZTCRFIQSDXNKAF-SOFGYWHQSA-N
MW124.19 g/mol
LogP1.25
Rot. Bonds1

About N-methyl-1-(2-methylidenepyrrolidin-1-yl)methanimine

N-methyl-1-(2-methylidenepyrrolidin-1-yl)methanimine (PubChem CID 145316269) has the molecular formula C7H12N2 and a molecular weight of 124.19 g/mol. Its IUPAC name is N-methyl-1-(2-methylidenepyrrolidin-1-yl)methanimine.

Molecular Properties

Compound NameN-methyl-1-(2-methylidenepyrrolidin-1-yl)methanimine
PubChem CID145316269
Molecular FormulaC7H12N2
Molecular Weight124.19 g/mol
Exact Mass124.10
IUPAC NameN-methyl-1-(2-methylidenepyrrolidin-1-yl)methanimine
SMILESC=C1CCCN1/C=N/C
InChIInChI=1S/C7H12N2/c1-7-4-3-5-9(7)6-8-2/h6H,1,3-5H2,2H3/b8-6+
InChIKeyZTCRFIQSDXNKAF-SOFGYWHQSA-N
XLogP1.25
TPSA15.60 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds1
Heavy Atoms9
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500124.19
LogP ≤ 51.25
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'imine_1', 'substructure': 'N/A'}, {'alert_name': 'imine_2', 'substructure': 'N/A'}

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Frequently Asked Questions

What is the IUPAC name of N-methyl-1-(2-methylidenepyrrolidin-1-yl)methanimine?
The IUPAC name of N-methyl-1-(2-methylidenepyrrolidin-1-yl)methanimine (CID 145316269) is N-methyl-1-(2-methylidenepyrrolidin-1-yl)methanimine.
What is the SMILES notation for N-methyl-1-(2-methylidenepyrrolidin-1-yl)methanimine?
The canonical SMILES for N-methyl-1-(2-methylidenepyrrolidin-1-yl)methanimine is C=C1CCCN1/C=N/C.
What is the InChIKey of N-methyl-1-(2-methylidenepyrrolidin-1-yl)methanimine?
The InChIKey is ZTCRFIQSDXNKAF-SOFGYWHQSA-N. The full InChI is InChI=1S/C7H12N2/c1-7-4-3-5-9(7)6-8-2/h6H,1,3-5H2,2H3/b8-6+.
What are the key properties of N-methyl-1-(2-methylidenepyrrolidin-1-yl)methanimine?
N-methyl-1-(2-methylidenepyrrolidin-1-yl)methanimine has a molecular weight of 124.19 g/mol, XLogP of 1.25, 1 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for N-methyl-1-(2-methylidenepyrrolidin-1-yl)methanimine is sourced from PubChem (CID 145316269), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).