2,2-diethyl-N-methyl-3-(oxan-4-yloxy)cyclobutan-1-amine

C14H27NO2 — CID 66350897

IUPAC2,2-diethyl-N-methyl-3-(oxan-4-yloxy)cyclobutan-1-amine
SMILESCCC1(CC)C(NC)CC1OC1CCOCC1
InChIInChI=1S/C14H27NO2/c1-4-14(5-2)12(15-3)10-13(14)17-11-6-8-16-9-7-11/h11-13,15H,4-10H2,1-3H3
InChIKeyIRKYNLIKSKTBOO-UHFFFAOYSA-N
MW241.37 g/mol
LogP2.35
Rot. Bonds5

About 2,2-diethyl-N-methyl-3-(oxan-4-yloxy)cyclobutan-1-amine

2,2-diethyl-N-methyl-3-(oxan-4-yloxy)cyclobutan-1-amine (PubChem CID 66350897) has the molecular formula C14H27NO2 and a molecular weight of 241.37 g/mol. Its IUPAC name is 2,2-diethyl-N-methyl-3-(oxan-4-yloxy)cyclobutan-1-amine.

Molecular Properties

Compound Name2,2-diethyl-N-methyl-3-(oxan-4-yloxy)cyclobutan-1-amine
PubChem CID66350897
Molecular FormulaC14H27NO2
Molecular Weight241.37 g/mol
Exact Mass241.20
IUPAC Name2,2-diethyl-N-methyl-3-(oxan-4-yloxy)cyclobutan-1-amine
SMILESCCC1(CC)C(NC)CC1OC1CCOCC1
InChIInChI=1S/C14H27NO2/c1-4-14(5-2)12(15-3)10-13(14)17-11-6-8-16-9-7-11/h11-13,15H,4-10H2,1-3H3
InChIKeyIRKYNLIKSKTBOO-UHFFFAOYSA-N
XLogP2.35
TPSA30.49 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500241.37
LogP ≤ 52.35
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 2,2-diethyl-N-methyl-3-(oxan-4-yloxy)cyclobutan-1-amine?
The IUPAC name of 2,2-diethyl-N-methyl-3-(oxan-4-yloxy)cyclobutan-1-amine (CID 66350897) is 2,2-diethyl-N-methyl-3-(oxan-4-yloxy)cyclobutan-1-amine.
What is the SMILES notation for 2,2-diethyl-N-methyl-3-(oxan-4-yloxy)cyclobutan-1-amine?
The canonical SMILES for 2,2-diethyl-N-methyl-3-(oxan-4-yloxy)cyclobutan-1-amine is CCC1(CC)C(NC)CC1OC1CCOCC1.
What is the InChIKey of 2,2-diethyl-N-methyl-3-(oxan-4-yloxy)cyclobutan-1-amine?
The InChIKey is IRKYNLIKSKTBOO-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H27NO2/c1-4-14(5-2)12(15-3)10-13(14)17-11-6-8-16-9-7-11/h11-13,15H,4-10H2,1-3H3.
What are the key properties of 2,2-diethyl-N-methyl-3-(oxan-4-yloxy)cyclobutan-1-amine?
2,2-diethyl-N-methyl-3-(oxan-4-yloxy)cyclobutan-1-amine has a molecular weight of 241.37 g/mol, XLogP of 2.35, 5 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2,2-diethyl-N-methyl-3-(oxan-4-yloxy)cyclobutan-1-amine is sourced from PubChem (CID 66350897), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).