2-[(3-methoxycyclobutyl)amino]-N-(2-methoxyethyl)acetamide

C10H20N2O3 — CID 104872016

IUPAC2-[(3-methoxycyclobutyl)amino]-N-(2-methoxyethyl)acetamide
SMILESCOCCNC(=O)CNC1CC(OC)C1
InChIInChI=1S/C10H20N2O3/c1-14-4-3-11-10(13)7-12-8-5-9(6-8)15-2/h8-9,12H,3-7H2,1-2H3,(H,11,13)
InChIKeyBGVHICDXDDGGEH-UHFFFAOYSA-N
MW216.28 g/mol
LogP-0.48
Rot. Bonds7

About 2-[(3-methoxycyclobutyl)amino]-N-(2-methoxyethyl)acetamide

2-[(3-methoxycyclobutyl)amino]-N-(2-methoxyethyl)acetamide (PubChem CID 104872016) has the molecular formula C10H20N2O3 and a molecular weight of 216.28 g/mol. Its IUPAC name is 2-[(3-methoxycyclobutyl)amino]-N-(2-methoxyethyl)acetamide.

Molecular Properties

Compound Name2-[(3-methoxycyclobutyl)amino]-N-(2-methoxyethyl)acetamide
PubChem CID104872016
Molecular FormulaC10H20N2O3
Molecular Weight216.28 g/mol
Exact Mass216.15
IUPAC Name2-[(3-methoxycyclobutyl)amino]-N-(2-methoxyethyl)acetamide
SMILESCOCCNC(=O)CNC1CC(OC)C1
InChIInChI=1S/C10H20N2O3/c1-14-4-3-11-10(13)7-12-8-5-9(6-8)15-2/h8-9,12H,3-7H2,1-2H3,(H,11,13)
InChIKeyBGVHICDXDDGGEH-UHFFFAOYSA-N
XLogP-0.48
TPSA59.59 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds7
Heavy Atoms15
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500216.28
LogP ≤ 5-0.48
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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-[(3-methoxycyclobutyl)amino]-N-(2-methoxyethyl)acetamide?
The IUPAC name of 2-[(3-methoxycyclobutyl)amino]-N-(2-methoxyethyl)acetamide (CID 104872016) is 2-[(3-methoxycyclobutyl)amino]-N-(2-methoxyethyl)acetamide.
What is the SMILES notation for 2-[(3-methoxycyclobutyl)amino]-N-(2-methoxyethyl)acetamide?
The canonical SMILES for 2-[(3-methoxycyclobutyl)amino]-N-(2-methoxyethyl)acetamide is COCCNC(=O)CNC1CC(OC)C1.
What is the InChIKey of 2-[(3-methoxycyclobutyl)amino]-N-(2-methoxyethyl)acetamide?
The InChIKey is BGVHICDXDDGGEH-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H20N2O3/c1-14-4-3-11-10(13)7-12-8-5-9(6-8)15-2/h8-9,12H,3-7H2,1-2H3,(H,11,13).
What are the key properties of 2-[(3-methoxycyclobutyl)amino]-N-(2-methoxyethyl)acetamide?
2-[(3-methoxycyclobutyl)amino]-N-(2-methoxyethyl)acetamide has a molecular weight of 216.28 g/mol, XLogP of -0.48, 7 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[(3-methoxycyclobutyl)amino]-N-(2-methoxyethyl)acetamide is sourced from PubChem (CID 104872016), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).