1,1-bis(azetidin-1-yl)-N-methylmethanimine

C8H15N3 — CID 166858642

IUPAC1,1-bis(azetidin-1-yl)-N-methylmethanimine
SMILESCN=C(N1CCC1)N1CCC1
InChIInChI=1S/C8H15N3/c1-9-8(10-4-2-5-10)11-6-3-7-11/h2-7H2,1H3
InChIKeyGQOGODGNMFGVBY-UHFFFAOYSA-N
MW153.23 g/mol
LogP0.38
Rot. Bonds

About 1,1-bis(azetidin-1-yl)-N-methylmethanimine

1,1-bis(azetidin-1-yl)-N-methylmethanimine (PubChem CID 166858642) has the molecular formula C8H15N3 and a molecular weight of 153.23 g/mol. Its IUPAC name is 1,1-bis(azetidin-1-yl)-N-methylmethanimine.

Molecular Properties

Compound Name1,1-bis(azetidin-1-yl)-N-methylmethanimine
PubChem CID166858642
Molecular FormulaC8H15N3
Molecular Weight153.23 g/mol
Exact Mass153.13
IUPAC Name1,1-bis(azetidin-1-yl)-N-methylmethanimine
SMILESCN=C(N1CCC1)N1CCC1
InChIInChI=1S/C8H15N3/c1-9-8(10-4-2-5-10)11-6-3-7-11/h2-7H2,1H3
InChIKeyGQOGODGNMFGVBY-UHFFFAOYSA-N
XLogP0.38
TPSA18.84 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500153.23
LogP ≤ 50.38
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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Related Compounds

ethane;N-methyl-1-morpholin-4-yl-1-pyrrolidin-1-ylmethanimine
CID 176964319
N-methyl-1-pyrrolidin-1-ylethanimine
CID 18728217
N'-methylazocane-1-carboximidamide
CID 62359325
N-tert-butyl-1,1-dipyrrolidin-1-ylmethanimine
CID 165163690
N,2,2-trimethyl-1-pyrrolidin-1-ylpropan-1-imine
CID 58320086
1-(azetidin-1-yl)ethanone
CID 14061673
N-methylpyrrolidine-1-carboximidoyl cyanide
CID 123728316
1-(azepan-1-yl)-N-methylpropan-1-imine
CID 123959692
N-methyl-1-(4-methylphenyl)-1-piperidin-1-ylmethanimine
CID 3049227
dipyrrolidin-1-ylmethylidenecyanamide
CID 101164131
N-ethyl-N'-methylpyrrolidine-1-carboximidamide;hydroiodide
CID 131039665
(dipyrrolidin-1-ylmethylideneamino)-methylphosphinate
CID 161114274

Frequently Asked Questions

What is the IUPAC name of 1,1-bis(azetidin-1-yl)-N-methylmethanimine?
The IUPAC name of 1,1-bis(azetidin-1-yl)-N-methylmethanimine (CID 166858642) is 1,1-bis(azetidin-1-yl)-N-methylmethanimine.
What is the SMILES notation for 1,1-bis(azetidin-1-yl)-N-methylmethanimine?
The canonical SMILES for 1,1-bis(azetidin-1-yl)-N-methylmethanimine is CN=C(N1CCC1)N1CCC1.
What is the InChIKey of 1,1-bis(azetidin-1-yl)-N-methylmethanimine?
The InChIKey is GQOGODGNMFGVBY-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H15N3/c1-9-8(10-4-2-5-10)11-6-3-7-11/h2-7H2,1H3.
What are the key properties of 1,1-bis(azetidin-1-yl)-N-methylmethanimine?
1,1-bis(azetidin-1-yl)-N-methylmethanimine has a molecular weight of 153.23 g/mol, XLogP of 0.38, 0 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 1,1-bis(azetidin-1-yl)-N-methylmethanimine is sourced from PubChem (CID 166858642), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).