N-(3-ethoxy-2-ethyl-2-methylcyclobutyl)piperidin-1-amine

C14H28N2O — CID 83007276

IUPACN-(3-ethoxy-2-ethyl-2-methylcyclobutyl)piperidin-1-amine
SMILESCCOC1CC(NN2CCCCC2)C1(C)CC
InChIInChI=1S/C14H28N2O/c1-4-14(3)12(11-13(14)17-5-2)15-16-9-7-6-8-10-16/h12-13,15H,4-11H2,1-3H3
InChIKeyJEPUWFPNMSOSMC-UHFFFAOYSA-N
MW240.39 g/mol
LogP2.57
Rot. Bonds5

About N-(3-ethoxy-2-ethyl-2-methylcyclobutyl)piperidin-1-amine

N-(3-ethoxy-2-ethyl-2-methylcyclobutyl)piperidin-1-amine (PubChem CID 83007276) has the molecular formula C14H28N2O and a molecular weight of 240.39 g/mol. Its IUPAC name is N-(3-ethoxy-2-ethyl-2-methylcyclobutyl)piperidin-1-amine.

Molecular Properties

Compound NameN-(3-ethoxy-2-ethyl-2-methylcyclobutyl)piperidin-1-amine
PubChem CID83007276
Molecular FormulaC14H28N2O
Molecular Weight240.39 g/mol
Exact Mass240.22
IUPAC NameN-(3-ethoxy-2-ethyl-2-methylcyclobutyl)piperidin-1-amine
SMILESCCOC1CC(NN2CCCCC2)C1(C)CC
InChIInChI=1S/C14H28N2O/c1-4-14(3)12(11-13(14)17-5-2)15-16-9-7-6-8-10-16/h12-13,15H,4-11H2,1-3H3
InChIKeyJEPUWFPNMSOSMC-UHFFFAOYSA-N
XLogP2.57
TPSA24.50 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500240.39
LogP ≤ 52.57
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-ethyl-2-methylcyclobutyl)piperidin-1-amine?
The IUPAC name of N-(3-ethoxy-2-ethyl-2-methylcyclobutyl)piperidin-1-amine (CID 83007276) is N-(3-ethoxy-2-ethyl-2-methylcyclobutyl)piperidin-1-amine.
What is the SMILES notation for N-(3-ethoxy-2-ethyl-2-methylcyclobutyl)piperidin-1-amine?
The canonical SMILES for N-(3-ethoxy-2-ethyl-2-methylcyclobutyl)piperidin-1-amine is CCOC1CC(NN2CCCCC2)C1(C)CC.
What is the InChIKey of N-(3-ethoxy-2-ethyl-2-methylcyclobutyl)piperidin-1-amine?
The InChIKey is JEPUWFPNMSOSMC-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H28N2O/c1-4-14(3)12(11-13(14)17-5-2)15-16-9-7-6-8-10-16/h12-13,15H,4-11H2,1-3H3.
What are the key properties of N-(3-ethoxy-2-ethyl-2-methylcyclobutyl)piperidin-1-amine?
N-(3-ethoxy-2-ethyl-2-methylcyclobutyl)piperidin-1-amine has a molecular weight of 240.39 g/mol, XLogP of 2.57, 5 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-(3-ethoxy-2-ethyl-2-methylcyclobutyl)piperidin-1-amine is sourced from PubChem (CID 83007276), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).