2-(2-aminoethoxy)-N-(cyclobutylmethyl)-N-methylacetamide

C10H20N2O2 — CID 79479227

IUPAC2-(2-aminoethoxy)-N-(cyclobutylmethyl)-N-methylacetamide
SMILESCN(CC1CCC1)C(=O)COCCN
InChIInChI=1S/C10H20N2O2/c1-12(7-9-3-2-4-9)10(13)8-14-6-5-11/h9H,2-8,11H2,1H3
InChIKeyXPCTZFYYCUYZIC-UHFFFAOYSA-N
MW200.28 g/mol
LogP0.22
Rot. Bonds6

About 2-(2-aminoethoxy)-N-(cyclobutylmethyl)-N-methylacetamide

2-(2-aminoethoxy)-N-(cyclobutylmethyl)-N-methylacetamide (PubChem CID 79479227) has the molecular formula C10H20N2O2 and a molecular weight of 200.28 g/mol. Its IUPAC name is 2-(2-aminoethoxy)-N-(cyclobutylmethyl)-N-methylacetamide.

Molecular Properties

Compound Name2-(2-aminoethoxy)-N-(cyclobutylmethyl)-N-methylacetamide
PubChem CID79479227
Molecular FormulaC10H20N2O2
Molecular Weight200.28 g/mol
Exact Mass200.15
IUPAC Name2-(2-aminoethoxy)-N-(cyclobutylmethyl)-N-methylacetamide
SMILESCN(CC1CCC1)C(=O)COCCN
InChIInChI=1S/C10H20N2O2/c1-12(7-9-3-2-4-9)10(13)8-14-6-5-11/h9H,2-8,11H2,1H3
InChIKeyXPCTZFYYCUYZIC-UHFFFAOYSA-N
XLogP0.22
TPSA55.56 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds6
Heavy Atoms14
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500200.28
LogP ≤ 50.22
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Aliphatic_long_chain', 'substructure': 'N/A'}

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Frequently Asked Questions

What is the IUPAC name of 2-(2-aminoethoxy)-N-(cyclobutylmethyl)-N-methylacetamide?
The IUPAC name of 2-(2-aminoethoxy)-N-(cyclobutylmethyl)-N-methylacetamide (CID 79479227) is 2-(2-aminoethoxy)-N-(cyclobutylmethyl)-N-methylacetamide.
What is the SMILES notation for 2-(2-aminoethoxy)-N-(cyclobutylmethyl)-N-methylacetamide?
The canonical SMILES for 2-(2-aminoethoxy)-N-(cyclobutylmethyl)-N-methylacetamide is CN(CC1CCC1)C(=O)COCCN.
What is the InChIKey of 2-(2-aminoethoxy)-N-(cyclobutylmethyl)-N-methylacetamide?
The InChIKey is XPCTZFYYCUYZIC-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H20N2O2/c1-12(7-9-3-2-4-9)10(13)8-14-6-5-11/h9H,2-8,11H2,1H3.
What are the key properties of 2-(2-aminoethoxy)-N-(cyclobutylmethyl)-N-methylacetamide?
2-(2-aminoethoxy)-N-(cyclobutylmethyl)-N-methylacetamide has a molecular weight of 200.28 g/mol, XLogP of 0.22, 6 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(2-aminoethoxy)-N-(cyclobutylmethyl)-N-methylacetamide is sourced from PubChem (CID 79479227), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).