N-tert-butyl-2-(3-methoxyazetidin-1-yl)acetamide

C10H20N2O2 — CID 129033912

IUPACN-tert-butyl-2-(3-methoxyazetidin-1-yl)acetamide
SMILESCOC1CN(CC(=O)NC(C)(C)C)C1
InChIInChI=1S/C10H20N2O2/c1-10(2,3)11-9(13)7-12-5-8(6-12)14-4/h8H,5-7H2,1-4H3,(H,11,13)
InChIKeyMURZHUAYTRFPOS-UHFFFAOYSA-N
MW200.28 g/mol
LogP0.23
Rot. Bonds3

About N-tert-butyl-2-(3-methoxyazetidin-1-yl)acetamide

N-tert-butyl-2-(3-methoxyazetidin-1-yl)acetamide (PubChem CID 129033912) has the molecular formula C10H20N2O2 and a molecular weight of 200.28 g/mol. Its IUPAC name is N-tert-butyl-2-(3-methoxyazetidin-1-yl)acetamide.

Molecular Properties

Compound NameN-tert-butyl-2-(3-methoxyazetidin-1-yl)acetamide
PubChem CID129033912
Molecular FormulaC10H20N2O2
Molecular Weight200.28 g/mol
Exact Mass200.15
IUPAC NameN-tert-butyl-2-(3-methoxyazetidin-1-yl)acetamide
SMILESCOC1CN(CC(=O)NC(C)(C)C)C1
InChIInChI=1S/C10H20N2O2/c1-10(2,3)11-9(13)7-12-5-8(6-12)14-4/h8H,5-7H2,1-4H3,(H,11,13)
InChIKeyMURZHUAYTRFPOS-UHFFFAOYSA-N
XLogP0.23
TPSA41.57 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500200.28
LogP ≤ 50.23
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of N-tert-butyl-2-(3-methoxyazetidin-1-yl)acetamide?
The IUPAC name of N-tert-butyl-2-(3-methoxyazetidin-1-yl)acetamide (CID 129033912) is N-tert-butyl-2-(3-methoxyazetidin-1-yl)acetamide.
What is the SMILES notation for N-tert-butyl-2-(3-methoxyazetidin-1-yl)acetamide?
The canonical SMILES for N-tert-butyl-2-(3-methoxyazetidin-1-yl)acetamide is COC1CN(CC(=O)NC(C)(C)C)C1.
What is the InChIKey of N-tert-butyl-2-(3-methoxyazetidin-1-yl)acetamide?
The InChIKey is MURZHUAYTRFPOS-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H20N2O2/c1-10(2,3)11-9(13)7-12-5-8(6-12)14-4/h8H,5-7H2,1-4H3,(H,11,13).
What are the key properties of N-tert-butyl-2-(3-methoxyazetidin-1-yl)acetamide?
N-tert-butyl-2-(3-methoxyazetidin-1-yl)acetamide has a molecular weight of 200.28 g/mol, XLogP of 0.23, 3 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-tert-butyl-2-(3-methoxyazetidin-1-yl)acetamide is sourced from PubChem (CID 129033912), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).