N-(3-ethoxy-2,2-dimethylcyclobutyl)-2,6-dimethylpiperidin-1-amine

C15H30N2O — CID 83006418

IUPACN-(3-ethoxy-2,2-dimethylcyclobutyl)-2,6-dimethylpiperidin-1-amine
SMILESCCOC1CC(NN2C(C)CCCC2C)C1(C)C
InChIInChI=1S/C15H30N2O/c1-6-18-14-10-13(15(14,4)5)16-17-11(2)8-7-9-12(17)3/h11-14,16H,6-10H2,1-5H3
InChIKeySFCVCMMPAAVMNX-UHFFFAOYSA-N
MW254.42 g/mol
LogP2.96
Rot. Bonds4

About N-(3-ethoxy-2,2-dimethylcyclobutyl)-2,6-dimethylpiperidin-1-amine

N-(3-ethoxy-2,2-dimethylcyclobutyl)-2,6-dimethylpiperidin-1-amine (PubChem CID 83006418) has the molecular formula C15H30N2O and a molecular weight of 254.42 g/mol. Its IUPAC name is N-(3-ethoxy-2,2-dimethylcyclobutyl)-2,6-dimethylpiperidin-1-amine.

Molecular Properties

Compound NameN-(3-ethoxy-2,2-dimethylcyclobutyl)-2,6-dimethylpiperidin-1-amine
PubChem CID83006418
Molecular FormulaC15H30N2O
Molecular Weight254.42 g/mol
Exact Mass254.24
IUPAC NameN-(3-ethoxy-2,2-dimethylcyclobutyl)-2,6-dimethylpiperidin-1-amine
SMILESCCOC1CC(NN2C(C)CCCC2C)C1(C)C
InChIInChI=1S/C15H30N2O/c1-6-18-14-10-13(15(14,4)5)16-17-11(2)8-7-9-12(17)3/h11-14,16H,6-10H2,1-5H3
InChIKeySFCVCMMPAAVMNX-UHFFFAOYSA-N
XLogP2.96
TPSA24.50 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500254.42
LogP ≤ 52.96
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of N-(3-ethoxy-2,2-dimethylcyclobutyl)-2,6-dimethylpiperidin-1-amine?
The IUPAC name of N-(3-ethoxy-2,2-dimethylcyclobutyl)-2,6-dimethylpiperidin-1-amine (CID 83006418) is N-(3-ethoxy-2,2-dimethylcyclobutyl)-2,6-dimethylpiperidin-1-amine.
What is the SMILES notation for N-(3-ethoxy-2,2-dimethylcyclobutyl)-2,6-dimethylpiperidin-1-amine?
The canonical SMILES for N-(3-ethoxy-2,2-dimethylcyclobutyl)-2,6-dimethylpiperidin-1-amine is CCOC1CC(NN2C(C)CCCC2C)C1(C)C.
What is the InChIKey of N-(3-ethoxy-2,2-dimethylcyclobutyl)-2,6-dimethylpiperidin-1-amine?
The InChIKey is SFCVCMMPAAVMNX-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H30N2O/c1-6-18-14-10-13(15(14,4)5)16-17-11(2)8-7-9-12(17)3/h11-14,16H,6-10H2,1-5H3.
What are the key properties of N-(3-ethoxy-2,2-dimethylcyclobutyl)-2,6-dimethylpiperidin-1-amine?
N-(3-ethoxy-2,2-dimethylcyclobutyl)-2,6-dimethylpiperidin-1-amine has a molecular weight of 254.42 g/mol, XLogP of 2.96, 4 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-(3-ethoxy-2,2-dimethylcyclobutyl)-2,6-dimethylpiperidin-1-amine is sourced from PubChem (CID 83006418), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).