3-methoxy-N-(3-methylbutan-2-yl)cyclobutan-1-amine

C10H21NO — CID 104584492

IUPAC3-methoxy-N-(3-methylbutan-2-yl)cyclobutan-1-amine
SMILESCOC1CC(NC(C)C(C)C)C1
InChIInChI=1S/C10H21NO/c1-7(2)8(3)11-9-5-10(6-9)12-4/h7-11H,5-6H2,1-4H3
InChIKeyUAEUDFRKGVSWLE-UHFFFAOYSA-N
MW171.28 g/mol
LogP1.80
Rot. Bonds4

About 3-methoxy-N-(3-methylbutan-2-yl)cyclobutan-1-amine

3-methoxy-N-(3-methylbutan-2-yl)cyclobutan-1-amine (PubChem CID 104584492) has the molecular formula C10H21NO and a molecular weight of 171.28 g/mol. Its IUPAC name is 3-methoxy-N-(3-methylbutan-2-yl)cyclobutan-1-amine.

Molecular Properties

Compound Name3-methoxy-N-(3-methylbutan-2-yl)cyclobutan-1-amine
PubChem CID104584492
Molecular FormulaC10H21NO
Molecular Weight171.28 g/mol
Exact Mass171.16
IUPAC Name3-methoxy-N-(3-methylbutan-2-yl)cyclobutan-1-amine
SMILESCOC1CC(NC(C)C(C)C)C1
InChIInChI=1S/C10H21NO/c1-7(2)8(3)11-9-5-10(6-9)12-4/h7-11H,5-6H2,1-4H3
InChIKeyUAEUDFRKGVSWLE-UHFFFAOYSA-N
XLogP1.80
TPSA21.26 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500171.28
LogP ≤ 51.80
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Analyze 3-methoxy-N-(3-methylbutan-2-yl)cyclobutan-1-amine with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Frequently Asked Questions

What is the IUPAC name of 3-methoxy-N-(3-methylbutan-2-yl)cyclobutan-1-amine?
The IUPAC name of 3-methoxy-N-(3-methylbutan-2-yl)cyclobutan-1-amine (CID 104584492) is 3-methoxy-N-(3-methylbutan-2-yl)cyclobutan-1-amine.
What is the SMILES notation for 3-methoxy-N-(3-methylbutan-2-yl)cyclobutan-1-amine?
The canonical SMILES for 3-methoxy-N-(3-methylbutan-2-yl)cyclobutan-1-amine is COC1CC(NC(C)C(C)C)C1.
What is the InChIKey of 3-methoxy-N-(3-methylbutan-2-yl)cyclobutan-1-amine?
The InChIKey is UAEUDFRKGVSWLE-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H21NO/c1-7(2)8(3)11-9-5-10(6-9)12-4/h7-11H,5-6H2,1-4H3.
What are the key properties of 3-methoxy-N-(3-methylbutan-2-yl)cyclobutan-1-amine?
3-methoxy-N-(3-methylbutan-2-yl)cyclobutan-1-amine has a molecular weight of 171.28 g/mol, XLogP of 1.80, 4 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 3-methoxy-N-(3-methylbutan-2-yl)cyclobutan-1-amine is sourced from PubChem (CID 104584492), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).