3-cyclobutyl-2-ethylazetidine

C9H17N — CID 126747573

IUPAC3-cyclobutyl-2-ethylazetidine
SMILESCCC1NCC1C1CCC1
InChIInChI=1S/C9H17N/c1-2-9-8(6-10-9)7-4-3-5-7/h7-10H,2-6H2,1H3
InChIKeyZFABSOSDLJDSMG-UHFFFAOYSA-N
MW139.24 g/mol
LogP1.78
Rot. Bonds2

About 3-cyclobutyl-2-ethylazetidine

3-cyclobutyl-2-ethylazetidine (PubChem CID 126747573) has the molecular formula C9H17N and a molecular weight of 139.24 g/mol. Its IUPAC name is 3-cyclobutyl-2-ethylazetidine.

Molecular Properties

Compound Name3-cyclobutyl-2-ethylazetidine
PubChem CID126747573
Molecular FormulaC9H17N
Molecular Weight139.24 g/mol
Exact Mass139.14
IUPAC Name3-cyclobutyl-2-ethylazetidine
SMILESCCC1NCC1C1CCC1
InChIInChI=1S/C9H17N/c1-2-9-8(6-10-9)7-4-3-5-7/h7-10H,2-6H2,1H3
InChIKeyZFABSOSDLJDSMG-UHFFFAOYSA-N
XLogP1.78
TPSA12.03 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds2
Heavy Atoms10
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500139.24
LogP ≤ 51.78
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

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Related Compounds

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2-cyclobutyl-3-cyclopropylazetidine
CID 131197284
1-cyclobutyl-2-ethylcyclobutane
CID 123211451
N-(1,2,3,3a,4,5,6,6a-octahydrocyclopenta[c]pyrrol-3-ylmethyl)-N-methylethanamine
CID 102894266
2-ethyl-3-(oxan-3-yl)pyrrolidine
CID 63739901
[(3S,3aS,6aR)-1,2,3,3a,4,5,6,6a-octahydrocyclopenta[c]pyrrol-3-yl]methanamine
CID 66703870
(1S,4aR,8aR)-1-ethyl-1,2,3,4,4a,5,6,7,8,8a-decahydronaphthalene
CID 165360268
3-(fluoromethyl)-1,2,3,3a,4,5,6,6a-octahydrocyclopenta[c]pyrrole;hydrochloride
CID 84718322
7-ethyl-6-azabicyclo[3.2.0]heptane
CID 153054846
2-cyclobutyl-5-(2-ethylcyclobutyl)bicyclo[4.2.0]octane
CID 165003699
1-ethyl-4,4-dimethyl-2,3,3a,6,7,7a-hexahydro-1H-pyrano[3,4-c]pyrrole
CID 130056901
(3aR,6aS)-1,2,3,3a,4,5,6,6a-octahydrocyclopenta[c]pyrrole;ethane;propane
CID 144941558

Frequently Asked Questions

What is the IUPAC name of 3-cyclobutyl-2-ethylazetidine?
The IUPAC name of 3-cyclobutyl-2-ethylazetidine (CID 126747573) is 3-cyclobutyl-2-ethylazetidine.
What is the SMILES notation for 3-cyclobutyl-2-ethylazetidine?
The canonical SMILES for 3-cyclobutyl-2-ethylazetidine is CCC1NCC1C1CCC1.
What is the InChIKey of 3-cyclobutyl-2-ethylazetidine?
The InChIKey is ZFABSOSDLJDSMG-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H17N/c1-2-9-8(6-10-9)7-4-3-5-7/h7-10H,2-6H2,1H3.
What are the key properties of 3-cyclobutyl-2-ethylazetidine?
3-cyclobutyl-2-ethylazetidine has a molecular weight of 139.24 g/mol, XLogP of 1.78, 2 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 3-cyclobutyl-2-ethylazetidine is sourced from PubChem (CID 126747573), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).