6-(2-butoxyethoxy)pyridin-3-amine

C11H18N2O2 — CID 3031377

IUPAC6-(2-butoxyethoxy)pyridin-3-amine
SMILESCCCCOCCOc1ccc(N)cn1
InChIInChI=1S/C11H18N2O2/c1-2-3-6-14-7-8-15-11-5-4-10(12)9-13-11/h4-5,9H,2-3,6-8,12H2,1H3
InChIKeyRYUWNPXQTKTPFF-UHFFFAOYSA-N
MW210.28 g/mol
LogP1.86
Rot. Bonds7

About 6-(2-butoxyethoxy)pyridin-3-amine

6-(2-butoxyethoxy)pyridin-3-amine (PubChem CID 3031377) has the molecular formula C11H18N2O2 and a molecular weight of 210.28 g/mol. Its IUPAC name is 6-(2-butoxyethoxy)pyridin-3-amine.

Molecular Properties

Compound Name6-(2-butoxyethoxy)pyridin-3-amine
PubChem CID3031377
Molecular FormulaC11H18N2O2
Molecular Weight210.28 g/mol
Exact Mass210.14
IUPAC Name6-(2-butoxyethoxy)pyridin-3-amine
SMILESCCCCOCCOc1ccc(N)cn1
InChIInChI=1S/C11H18N2O2/c1-2-3-6-14-7-8-15-11-5-4-10(12)9-13-11/h4-5,9H,2-3,6-8,12H2,1H3
InChIKeyRYUWNPXQTKTPFF-UHFFFAOYSA-N
XLogP1.86
TPSA57.37 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds7
Heavy Atoms15
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500210.28
LogP ≤ 51.86
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Aliphatic_long_chain', 'substructure': 'N/A'}

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Frequently Asked Questions

What is the IUPAC name of 6-(2-butoxyethoxy)pyridin-3-amine?
The IUPAC name of 6-(2-butoxyethoxy)pyridin-3-amine (CID 3031377) is 6-(2-butoxyethoxy)pyridin-3-amine.
What is the SMILES notation for 6-(2-butoxyethoxy)pyridin-3-amine?
The canonical SMILES for 6-(2-butoxyethoxy)pyridin-3-amine is CCCCOCCOc1ccc(N)cn1.
What is the InChIKey of 6-(2-butoxyethoxy)pyridin-3-amine?
The InChIKey is RYUWNPXQTKTPFF-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H18N2O2/c1-2-3-6-14-7-8-15-11-5-4-10(12)9-13-11/h4-5,9H,2-3,6-8,12H2,1H3.
What are the key properties of 6-(2-butoxyethoxy)pyridin-3-amine?
6-(2-butoxyethoxy)pyridin-3-amine has a molecular weight of 210.28 g/mol, XLogP of 1.86, 7 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 6-(2-butoxyethoxy)pyridin-3-amine is sourced from PubChem (CID 3031377), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).