3-ethyl-1-(1-methylazetidin-3-yl)azetidine

C9H18N2 — CID 164846605

IUPAC3-ethyl-1-(1-methylazetidin-3-yl)azetidine
SMILESCCC1CN(C2CN(C)C2)C1
InChIInChI=1S/C9H18N2/c1-3-8-4-11(5-8)9-6-10(2)7-9/h8-9H,3-7H2,1-2H3
InChIKeyGAZAJQOAVXQXRO-UHFFFAOYSA-N
MW154.26 g/mol
LogP0.64
Rot. Bonds2

About 3-ethyl-1-(1-methylazetidin-3-yl)azetidine

3-ethyl-1-(1-methylazetidin-3-yl)azetidine (PubChem CID 164846605) has the molecular formula C9H18N2 and a molecular weight of 154.26 g/mol. Its IUPAC name is 3-ethyl-1-(1-methylazetidin-3-yl)azetidine.

Molecular Properties

Compound Name3-ethyl-1-(1-methylazetidin-3-yl)azetidine
PubChem CID164846605
Molecular FormulaC9H18N2
Molecular Weight154.26 g/mol
Exact Mass154.15
IUPAC Name3-ethyl-1-(1-methylazetidin-3-yl)azetidine
SMILESCCC1CN(C2CN(C)C2)C1
InChIInChI=1S/C9H18N2/c1-3-8-4-11(5-8)9-6-10(2)7-9/h8-9H,3-7H2,1-2H3
InChIKeyGAZAJQOAVXQXRO-UHFFFAOYSA-N
XLogP0.64
TPSA6.48 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500154.26
LogP ≤ 50.64
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Related Compounds

3-(3-ethylazetidin-1-yl)-1-methylpyrrolidine
CID 164846501
1-cyclopentyl-3-ethylazetidine
CID 126716457
3-ethyl-1-azabicyclo[3.1.0]hexane
CID 59715797
3-(3-ethylazetidin-1-yl)-N-methylcyclobutan-1-amine
CID 164846609
3-ethyl-1-(3-methoxycyclobutyl)azetidine
CID 164846581
1-methyl-3-(3-propan-2-ylazetidin-1-yl)azetidine
CID 166046475
N,N-dimethyl-1-(1-methylazetidin-3-yl)azetidin-3-amine
CID 156546405
4-(3-ethylazetidin-1-yl)cyclohexane-1-carboxylic acid
CID 79694621
3-ethyl-1-(1-methylazetidin-3-yl)piperazine
CID 131042809
1,3-diethylazetidine;1,2-dimethylaziridine
CID 161379483
3-(azetidin-1-yl)-1-methylazetidine;ethane
CID 170747536
3-(3-ethylazetidin-1-yl)cyclopentane-1-carboxylic acid
CID 79689061

Frequently Asked Questions

What is the IUPAC name of 3-ethyl-1-(1-methylazetidin-3-yl)azetidine?
The IUPAC name of 3-ethyl-1-(1-methylazetidin-3-yl)azetidine (CID 164846605) is 3-ethyl-1-(1-methylazetidin-3-yl)azetidine.
What is the SMILES notation for 3-ethyl-1-(1-methylazetidin-3-yl)azetidine?
The canonical SMILES for 3-ethyl-1-(1-methylazetidin-3-yl)azetidine is CCC1CN(C2CN(C)C2)C1.
What is the InChIKey of 3-ethyl-1-(1-methylazetidin-3-yl)azetidine?
The InChIKey is GAZAJQOAVXQXRO-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H18N2/c1-3-8-4-11(5-8)9-6-10(2)7-9/h8-9H,3-7H2,1-2H3.
What are the key properties of 3-ethyl-1-(1-methylazetidin-3-yl)azetidine?
3-ethyl-1-(1-methylazetidin-3-yl)azetidine has a molecular weight of 154.26 g/mol, XLogP of 0.64, 2 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 3-ethyl-1-(1-methylazetidin-3-yl)azetidine is sourced from PubChem (CID 164846605), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).