N-(3-ethoxy-2-ethyl-2-methylcyclobutyl)-1-propan-2-ylpiperidin-4-amine

C17H34N2O — CID 65167851

IUPACN-(3-ethoxy-2-ethyl-2-methylcyclobutyl)-1-propan-2-ylpiperidin-4-amine
SMILESCCOC1CC(NC2CCN(C(C)C)CC2)C1(C)CC
InChIInChI=1S/C17H34N2O/c1-6-17(5)15(12-16(17)20-7-2)18-14-8-10-19(11-9-14)13(3)4/h13-16,18H,6-12H2,1-5H3
InChIKeyFZIDPAAAIJKTOI-UHFFFAOYSA-N
MW282.47 g/mol
LogP3.04
Rot. Bonds6

About N-(3-ethoxy-2-ethyl-2-methylcyclobutyl)-1-propan-2-ylpiperidin-4-amine

N-(3-ethoxy-2-ethyl-2-methylcyclobutyl)-1-propan-2-ylpiperidin-4-amine (PubChem CID 65167851) has the molecular formula C17H34N2O and a molecular weight of 282.47 g/mol. Its IUPAC name is N-(3-ethoxy-2-ethyl-2-methylcyclobutyl)-1-propan-2-ylpiperidin-4-amine.

Molecular Properties

Compound NameN-(3-ethoxy-2-ethyl-2-methylcyclobutyl)-1-propan-2-ylpiperidin-4-amine
PubChem CID65167851
Molecular FormulaC17H34N2O
Molecular Weight282.47 g/mol
Exact Mass282.27
IUPAC NameN-(3-ethoxy-2-ethyl-2-methylcyclobutyl)-1-propan-2-ylpiperidin-4-amine
SMILESCCOC1CC(NC2CCN(C(C)C)CC2)C1(C)CC
InChIInChI=1S/C17H34N2O/c1-6-17(5)15(12-16(17)20-7-2)18-14-8-10-19(11-9-14)13(3)4/h13-16,18H,6-12H2,1-5H3
InChIKeyFZIDPAAAIJKTOI-UHFFFAOYSA-N
XLogP3.04
TPSA24.50 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds6
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500282.47
LogP ≤ 53.04
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Analyze N-(3-ethoxy-2-ethyl-2-methylcyclobutyl)-1-propan-2-ylpiperidin-4-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 N-(3-ethoxy-2-ethyl-2-methylcyclobutyl)-1-propan-2-ylpiperidin-4-amine?
The IUPAC name of N-(3-ethoxy-2-ethyl-2-methylcyclobutyl)-1-propan-2-ylpiperidin-4-amine (CID 65167851) is N-(3-ethoxy-2-ethyl-2-methylcyclobutyl)-1-propan-2-ylpiperidin-4-amine.
What is the SMILES notation for N-(3-ethoxy-2-ethyl-2-methylcyclobutyl)-1-propan-2-ylpiperidin-4-amine?
The canonical SMILES for N-(3-ethoxy-2-ethyl-2-methylcyclobutyl)-1-propan-2-ylpiperidin-4-amine is CCOC1CC(NC2CCN(C(C)C)CC2)C1(C)CC.
What is the InChIKey of N-(3-ethoxy-2-ethyl-2-methylcyclobutyl)-1-propan-2-ylpiperidin-4-amine?
The InChIKey is FZIDPAAAIJKTOI-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H34N2O/c1-6-17(5)15(12-16(17)20-7-2)18-14-8-10-19(11-9-14)13(3)4/h13-16,18H,6-12H2,1-5H3.
What are the key properties of N-(3-ethoxy-2-ethyl-2-methylcyclobutyl)-1-propan-2-ylpiperidin-4-amine?
N-(3-ethoxy-2-ethyl-2-methylcyclobutyl)-1-propan-2-ylpiperidin-4-amine has a molecular weight of 282.47 g/mol, XLogP of 3.04, 6 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)-1-propan-2-ylpiperidin-4-amine is sourced from PubChem (CID 65167851), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).