2-(2,2,4-trimethylazetidin-1-yl)acetamide

C8H16N2O — CID 130709339

IUPAC2-(2,2,4-trimethylazetidin-1-yl)acetamide
SMILESCC1CC(C)(C)N1CC(N)=O
InChIInChI=1S/C8H16N2O/c1-6-4-8(2,3)10(6)5-7(9)11/h6H,4-5H2,1-3H3,(H2,9,11)
InChIKeyIRGGKKQWKSILFV-UHFFFAOYSA-N
MW156.23 g/mol
LogP0.34
Rot. Bonds2

About 2-(2,2,4-trimethylazetidin-1-yl)acetamide

2-(2,2,4-trimethylazetidin-1-yl)acetamide (PubChem CID 130709339) has the molecular formula C8H16N2O and a molecular weight of 156.23 g/mol. Its IUPAC name is 2-(2,2,4-trimethylazetidin-1-yl)acetamide.

Molecular Properties

Compound Name2-(2,2,4-trimethylazetidin-1-yl)acetamide
PubChem CID130709339
Molecular FormulaC8H16N2O
Molecular Weight156.23 g/mol
Exact Mass156.13
IUPAC Name2-(2,2,4-trimethylazetidin-1-yl)acetamide
SMILESCC1CC(C)(C)N1CC(N)=O
InChIInChI=1S/C8H16N2O/c1-6-4-8(2,3)10(6)5-7(9)11/h6H,4-5H2,1-3H3,(H2,9,11)
InChIKeyIRGGKKQWKSILFV-UHFFFAOYSA-N
XLogP0.34
TPSA46.33 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms11
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500156.23
LogP ≤ 50.34
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 2-(2,2,4-trimethylazetidin-1-yl)acetamide?
The IUPAC name of 2-(2,2,4-trimethylazetidin-1-yl)acetamide (CID 130709339) is 2-(2,2,4-trimethylazetidin-1-yl)acetamide.
What is the SMILES notation for 2-(2,2,4-trimethylazetidin-1-yl)acetamide?
The canonical SMILES for 2-(2,2,4-trimethylazetidin-1-yl)acetamide is CC1CC(C)(C)N1CC(N)=O.
What is the InChIKey of 2-(2,2,4-trimethylazetidin-1-yl)acetamide?
The InChIKey is IRGGKKQWKSILFV-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H16N2O/c1-6-4-8(2,3)10(6)5-7(9)11/h6H,4-5H2,1-3H3,(H2,9,11).
What are the key properties of 2-(2,2,4-trimethylazetidin-1-yl)acetamide?
2-(2,2,4-trimethylazetidin-1-yl)acetamide has a molecular weight of 156.23 g/mol, XLogP of 0.34, 2 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(2,2,4-trimethylazetidin-1-yl)acetamide is sourced from PubChem (CID 130709339), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).