3-(azetidin-1-yl)-1-methylazetidine;ethane

C9H20N2 — CID 170747536

IUPAC3-(azetidin-1-yl)-1-methylazetidine;ethane
SMILESCC.CN1CC(N2CCC2)C1
InChIInChI=1S/C7H14N2.C2H6/c1-8-5-7(6-8)9-3-2-4-9;1-2/h7H,2-6H2,1H3;1-2H3
InChIKeyDWXMUWFEQPFJMM-UHFFFAOYSA-N
MW156.27 g/mol
LogP1.03
Rot. Bonds1

About 3-(azetidin-1-yl)-1-methylazetidine;ethane

3-(azetidin-1-yl)-1-methylazetidine;ethane (PubChem CID 170747536) has the molecular formula C9H20N2 and a molecular weight of 156.27 g/mol. Its IUPAC name is 3-(azetidin-1-yl)-1-methylazetidine;ethane.

Molecular Properties

Compound Name3-(azetidin-1-yl)-1-methylazetidine;ethane
PubChem CID170747536
Molecular FormulaC9H20N2
Molecular Weight156.27 g/mol
Exact Mass156.16
IUPAC Name3-(azetidin-1-yl)-1-methylazetidine;ethane
SMILESCC.CN1CC(N2CCC2)C1
InChIInChI=1S/C7H14N2.C2H6/c1-8-5-7(6-8)9-3-2-4-9;1-2/h7H,2-6H2,1H3;1-2H3
InChIKeyDWXMUWFEQPFJMM-UHFFFAOYSA-N
XLogP1.03
TPSA6.48 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds1
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500156.27
LogP ≤ 51.03
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Related Compounds

ethane;1-(1-methylpyrrolidin-3-yl)azepane
CID 142272859
5-(1-methylazetidin-3-yl)-5-azaspiro[2.3]hexane
CID 166489027
3,3-difluoro-1-(1-methylazetidin-3-yl)azetidine
CID 122608330
2-methyl-3,4,6,7,8,8a-hexahydro-1H-pyrrolo[1,2-a]pyrazine;bis(1-methylpiperidine)
CID 158552360
1-methyl-3-(1-methylpiperidin-4-yl)-1,3-diazinane
CID 167009896
(4S)-4-(azetidin-1-yl)-1,2,2-trimethylpyrrolidine
CID 166869651
2-fluoro-8-methyl-3,4,6,7,9,9a-hexahydro-1H-pyrazino[1,2-a]pyrazine
CID 170582043
1-(1-methylazetidin-3-yl)piperidine-4-carboxamide
CID 166069617
7-methyl-2-[1-(1-methylazetidin-3-yl)piperidin-4-yl]-2-azaspiro[3.5]nonane
CID 170371772
ethane;[3-(4-methylpiperazin-1-yl)azetidin-1-yl]methanamine
CID 142368379
1-methyl-4-[1-(1-methylpyrrolidin-3-yl)azetidin-3-yl]piperazine
CID 167091081
ethane;1-methyl-4-piperidin-1-ylpiperidine;propane
CID 143818996

Frequently Asked Questions

What is the IUPAC name of 3-(azetidin-1-yl)-1-methylazetidine;ethane?
The IUPAC name of 3-(azetidin-1-yl)-1-methylazetidine;ethane (CID 170747536) is 3-(azetidin-1-yl)-1-methylazetidine;ethane.
What is the SMILES notation for 3-(azetidin-1-yl)-1-methylazetidine;ethane?
The canonical SMILES for 3-(azetidin-1-yl)-1-methylazetidine;ethane is CC.CN1CC(N2CCC2)C1.
What is the InChIKey of 3-(azetidin-1-yl)-1-methylazetidine;ethane?
The InChIKey is DWXMUWFEQPFJMM-UHFFFAOYSA-N. The full InChI is InChI=1S/C7H14N2.C2H6/c1-8-5-7(6-8)9-3-2-4-9;1-2/h7H,2-6H2,1H3;1-2H3.
What are the key properties of 3-(azetidin-1-yl)-1-methylazetidine;ethane?
3-(azetidin-1-yl)-1-methylazetidine;ethane has a molecular weight of 156.27 g/mol, XLogP of 1.03, 1 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 3-(azetidin-1-yl)-1-methylazetidine;ethane is sourced from PubChem (CID 170747536), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).