6-(2-ethoxyphenoxy)-2-propan-2-yloxypyridin-3-amine

C16H20N2O3 — CID 43262018

IUPAC6-(2-ethoxyphenoxy)-2-propan-2-yloxypyridin-3-amine
SMILESCCOc1ccccc1Oc1ccc(N)c(OC(C)C)n1
InChIInChI=1S/C16H20N2O3/c1-4-19-13-7-5-6-8-14(13)21-15-10-9-12(17)16(18-15)20-11(2)3/h5-11H,4,17H2,1-3H3
InChIKeyRLRLMUFPFCJMHE-UHFFFAOYSA-N
MW288.35 g/mol
LogP3.64
Rot. Bonds6

About 6-(2-ethoxyphenoxy)-2-propan-2-yloxypyridin-3-amine

6-(2-ethoxyphenoxy)-2-propan-2-yloxypyridin-3-amine (PubChem CID 43262018) has the molecular formula C16H20N2O3 and a molecular weight of 288.35 g/mol. Its IUPAC name is 6-(2-ethoxyphenoxy)-2-propan-2-yloxypyridin-3-amine.

Molecular Properties

Compound Name6-(2-ethoxyphenoxy)-2-propan-2-yloxypyridin-3-amine
PubChem CID43262018
Molecular FormulaC16H20N2O3
Molecular Weight288.35 g/mol
Exact Mass288.15
IUPAC Name6-(2-ethoxyphenoxy)-2-propan-2-yloxypyridin-3-amine
SMILESCCOc1ccccc1Oc1ccc(N)c(OC(C)C)n1
InChIInChI=1S/C16H20N2O3/c1-4-19-13-7-5-6-8-14(13)21-15-10-9-12(17)16(18-15)20-11(2)3/h5-11H,4,17H2,1-3H3
InChIKeyRLRLMUFPFCJMHE-UHFFFAOYSA-N
XLogP3.64
TPSA66.60 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds6
Heavy Atoms21
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500288.35
LogP ≤ 53.64
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Frequently Asked Questions

What is the IUPAC name of 6-(2-ethoxyphenoxy)-2-propan-2-yloxypyridin-3-amine?
The IUPAC name of 6-(2-ethoxyphenoxy)-2-propan-2-yloxypyridin-3-amine (CID 43262018) is 6-(2-ethoxyphenoxy)-2-propan-2-yloxypyridin-3-amine.
What is the SMILES notation for 6-(2-ethoxyphenoxy)-2-propan-2-yloxypyridin-3-amine?
The canonical SMILES for 6-(2-ethoxyphenoxy)-2-propan-2-yloxypyridin-3-amine is CCOc1ccccc1Oc1ccc(N)c(OC(C)C)n1.
What is the InChIKey of 6-(2-ethoxyphenoxy)-2-propan-2-yloxypyridin-3-amine?
The InChIKey is RLRLMUFPFCJMHE-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H20N2O3/c1-4-19-13-7-5-6-8-14(13)21-15-10-9-12(17)16(18-15)20-11(2)3/h5-11H,4,17H2,1-3H3.
What are the key properties of 6-(2-ethoxyphenoxy)-2-propan-2-yloxypyridin-3-amine?
6-(2-ethoxyphenoxy)-2-propan-2-yloxypyridin-3-amine has a molecular weight of 288.35 g/mol, XLogP of 3.64, 6 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 6-(2-ethoxyphenoxy)-2-propan-2-yloxypyridin-3-amine is sourced from PubChem (CID 43262018), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).