3-[(4-ethoxy-2-pyridinyl)oxy]cyclobutan-1-amine

C11H16N2O2 — CID 134579469

IUPAC3-[(4-ethoxy-2-pyridinyl)oxy]cyclobutan-1-amine
SMILESCCOc1ccnc(OC2CC(N)C2)c1
InChIInChI=1S/C11H16N2O2/c1-2-14-9-3-4-13-11(7-9)15-10-5-8(12)6-10/h3-4,7-8,10H,2,5-6,12H2,1H3
InChIKeyMAUQSADDQXCCIJ-UHFFFAOYSA-N
MW208.26 g/mol
LogP1.35
Rot. Bonds4

About 3-[(4-ethoxy-2-pyridinyl)oxy]cyclobutan-1-amine

3-[(4-ethoxy-2-pyridinyl)oxy]cyclobutan-1-amine (PubChem CID 134579469) has the molecular formula C11H16N2O2 and a molecular weight of 208.26 g/mol. Its IUPAC name is 3-[(4-ethoxy-2-pyridinyl)oxy]cyclobutan-1-amine.

Molecular Properties

Compound Name3-[(4-ethoxy-2-pyridinyl)oxy]cyclobutan-1-amine
PubChem CID134579469
Molecular FormulaC11H16N2O2
Molecular Weight208.26 g/mol
Exact Mass208.12
IUPAC Name3-[(4-ethoxy-2-pyridinyl)oxy]cyclobutan-1-amine
SMILESCCOc1ccnc(OC2CC(N)C2)c1
InChIInChI=1S/C11H16N2O2/c1-2-14-9-3-4-13-11(7-9)15-10-5-8(12)6-10/h3-4,7-8,10H,2,5-6,12H2,1H3
InChIKeyMAUQSADDQXCCIJ-UHFFFAOYSA-N
XLogP1.35
TPSA57.37 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms15
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500208.26
LogP ≤ 51.35
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of 3-[(4-ethoxy-2-pyridinyl)oxy]cyclobutan-1-amine?
The IUPAC name of 3-[(4-ethoxy-2-pyridinyl)oxy]cyclobutan-1-amine (CID 134579469) is 3-[(4-ethoxy-2-pyridinyl)oxy]cyclobutan-1-amine.
What is the SMILES notation for 3-[(4-ethoxy-2-pyridinyl)oxy]cyclobutan-1-amine?
The canonical SMILES for 3-[(4-ethoxy-2-pyridinyl)oxy]cyclobutan-1-amine is CCOc1ccnc(OC2CC(N)C2)c1.
What is the InChIKey of 3-[(4-ethoxy-2-pyridinyl)oxy]cyclobutan-1-amine?
The InChIKey is MAUQSADDQXCCIJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H16N2O2/c1-2-14-9-3-4-13-11(7-9)15-10-5-8(12)6-10/h3-4,7-8,10H,2,5-6,12H2,1H3.
What are the key properties of 3-[(4-ethoxy-2-pyridinyl)oxy]cyclobutan-1-amine?
3-[(4-ethoxy-2-pyridinyl)oxy]cyclobutan-1-amine has a molecular weight of 208.26 g/mol, XLogP of 1.35, 4 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 3-[(4-ethoxy-2-pyridinyl)oxy]cyclobutan-1-amine is sourced from PubChem (CID 134579469), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).