2-ethyl-2-[4-(3-ethylazetidin-3-yl)butan-2-yl]azetidine

C14H28N2 — CID 134524959

IUPAC2-ethyl-2-[4-(3-ethylazetidin-3-yl)butan-2-yl]azetidine
SMILESCCC1(CCC(C)C2(CC)CCN2)CNC1
InChIInChI=1S/C14H28N2/c1-4-13(10-15-11-13)7-6-12(3)14(5-2)8-9-16-14/h12,15-16H,4-11H2,1-3H3
InChIKeyJZNJJDSGQHFOFI-UHFFFAOYSA-N
MW224.39 g/mol
LogP2.54
Rot. Bonds6

About 2-ethyl-2-[4-(3-ethylazetidin-3-yl)butan-2-yl]azetidine

2-ethyl-2-[4-(3-ethylazetidin-3-yl)butan-2-yl]azetidine (PubChem CID 134524959) has the molecular formula C14H28N2 and a molecular weight of 224.39 g/mol. Its IUPAC name is 2-ethyl-2-[4-(3-ethylazetidin-3-yl)butan-2-yl]azetidine.

Molecular Properties

Compound Name2-ethyl-2-[4-(3-ethylazetidin-3-yl)butan-2-yl]azetidine
PubChem CID134524959
Molecular FormulaC14H28N2
Molecular Weight224.39 g/mol
Exact Mass224.23
IUPAC Name2-ethyl-2-[4-(3-ethylazetidin-3-yl)butan-2-yl]azetidine
SMILESCCC1(CCC(C)C2(CC)CCN2)CNC1
InChIInChI=1S/C14H28N2/c1-4-13(10-15-11-13)7-6-12(3)14(5-2)8-9-16-14/h12,15-16H,4-11H2,1-3H3
InChIKeyJZNJJDSGQHFOFI-UHFFFAOYSA-N
XLogP2.54
TPSA24.06 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds6
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500224.39
LogP ≤ 52.54
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Related Compounds

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CID 119032125
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N-[(3-ethylazetidin-3-yl)methyl]-N-methylpropan-2-amine
CID 165404355
3-(2-ethoxyethyl)-3-ethylazetidine
CID 79451036
N-[(3-ethylpyrrolidin-3-yl)methyl]propan-2-amine
CID 63143226
2-ethyl-2-propan-2-ylazepane
CID 79117006
3,6-diethyl-3-hexyl-6-pentylazepane
CID 59903813
N-[(3-ethylpiperidin-3-yl)methyl]propan-2-amine
CID 63133337
2-(2-methylpropyl)-2-pentan-2-ylpyrrolidine
CID 107896608
N-[(3-ethylpyrrolidin-3-yl)methyl]butan-2-amine
CID 63143274
2-butan-2-yl-2-propylpyrrolidine
CID 79443895

Frequently Asked Questions

What is the IUPAC name of 2-ethyl-2-[4-(3-ethylazetidin-3-yl)butan-2-yl]azetidine?
The IUPAC name of 2-ethyl-2-[4-(3-ethylazetidin-3-yl)butan-2-yl]azetidine (CID 134524959) is 2-ethyl-2-[4-(3-ethylazetidin-3-yl)butan-2-yl]azetidine.
What is the SMILES notation for 2-ethyl-2-[4-(3-ethylazetidin-3-yl)butan-2-yl]azetidine?
The canonical SMILES for 2-ethyl-2-[4-(3-ethylazetidin-3-yl)butan-2-yl]azetidine is CCC1(CCC(C)C2(CC)CCN2)CNC1.
What is the InChIKey of 2-ethyl-2-[4-(3-ethylazetidin-3-yl)butan-2-yl]azetidine?
The InChIKey is JZNJJDSGQHFOFI-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H28N2/c1-4-13(10-15-11-13)7-6-12(3)14(5-2)8-9-16-14/h12,15-16H,4-11H2,1-3H3.
What are the key properties of 2-ethyl-2-[4-(3-ethylazetidin-3-yl)butan-2-yl]azetidine?
2-ethyl-2-[4-(3-ethylazetidin-3-yl)butan-2-yl]azetidine has a molecular weight of 224.39 g/mol, XLogP of 2.54, 6 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-ethyl-2-[4-(3-ethylazetidin-3-yl)butan-2-yl]azetidine is sourced from PubChem (CID 134524959), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).