3-(2-cyclobutylethoxy)-2-ethyl-N,2-dimethylcyclobutan-1-amine

C14H27NO — CID 106207315

IUPAC3-(2-cyclobutylethoxy)-2-ethyl-N,2-dimethylcyclobutan-1-amine
SMILESCCC1(C)C(NC)CC1OCCC1CCC1
InChIInChI=1S/C14H27NO/c1-4-14(2)12(15-3)10-13(14)16-9-8-11-6-5-7-11/h11-13,15H,4-10H2,1-3H3
InChIKeyMYNVLDSYCKNGEB-UHFFFAOYSA-N
MW225.38 g/mol
LogP2.97
Rot. Bonds6

About 3-(2-cyclobutylethoxy)-2-ethyl-N,2-dimethylcyclobutan-1-amine

3-(2-cyclobutylethoxy)-2-ethyl-N,2-dimethylcyclobutan-1-amine (PubChem CID 106207315) has the molecular formula C14H27NO and a molecular weight of 225.38 g/mol. Its IUPAC name is 3-(2-cyclobutylethoxy)-2-ethyl-N,2-dimethylcyclobutan-1-amine.

Molecular Properties

Compound Name3-(2-cyclobutylethoxy)-2-ethyl-N,2-dimethylcyclobutan-1-amine
PubChem CID106207315
Molecular FormulaC14H27NO
Molecular Weight225.38 g/mol
Exact Mass225.21
IUPAC Name3-(2-cyclobutylethoxy)-2-ethyl-N,2-dimethylcyclobutan-1-amine
SMILESCCC1(C)C(NC)CC1OCCC1CCC1
InChIInChI=1S/C14H27NO/c1-4-14(2)12(15-3)10-13(14)16-9-8-11-6-5-7-11/h11-13,15H,4-10H2,1-3H3
InChIKeyMYNVLDSYCKNGEB-UHFFFAOYSA-N
XLogP2.97
TPSA21.26 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds6
Heavy Atoms16
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500225.38
LogP ≤ 52.97
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 3-(2-cyclobutylethoxy)-2-ethyl-N,2-dimethylcyclobutan-1-amine?
The IUPAC name of 3-(2-cyclobutylethoxy)-2-ethyl-N,2-dimethylcyclobutan-1-amine (CID 106207315) is 3-(2-cyclobutylethoxy)-2-ethyl-N,2-dimethylcyclobutan-1-amine.
What is the SMILES notation for 3-(2-cyclobutylethoxy)-2-ethyl-N,2-dimethylcyclobutan-1-amine?
The canonical SMILES for 3-(2-cyclobutylethoxy)-2-ethyl-N,2-dimethylcyclobutan-1-amine is CCC1(C)C(NC)CC1OCCC1CCC1.
What is the InChIKey of 3-(2-cyclobutylethoxy)-2-ethyl-N,2-dimethylcyclobutan-1-amine?
The InChIKey is MYNVLDSYCKNGEB-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H27NO/c1-4-14(2)12(15-3)10-13(14)16-9-8-11-6-5-7-11/h11-13,15H,4-10H2,1-3H3.
What are the key properties of 3-(2-cyclobutylethoxy)-2-ethyl-N,2-dimethylcyclobutan-1-amine?
3-(2-cyclobutylethoxy)-2-ethyl-N,2-dimethylcyclobutan-1-amine has a molecular weight of 225.38 g/mol, XLogP of 2.97, 6 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 3-(2-cyclobutylethoxy)-2-ethyl-N,2-dimethylcyclobutan-1-amine is sourced from PubChem (CID 106207315), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).