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

C16H20N2O2 — CID 43262374

IUPAC6-(3-ethylphenoxy)-2-propan-2-yloxypyridin-3-amine
SMILESCCc1cccc(Oc2ccc(N)c(OC(C)C)n2)c1
InChIInChI=1S/C16H20N2O2/c1-4-12-6-5-7-13(10-12)20-15-9-8-14(17)16(18-15)19-11(2)3/h5-11H,4,17H2,1-3H3
InChIKeyTZCDRYRFERCHRE-UHFFFAOYSA-N
MW272.35 g/mol
LogP3.81
Rot. Bonds5

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

6-(3-ethylphenoxy)-2-propan-2-yloxypyridin-3-amine (PubChem CID 43262374) has the molecular formula C16H20N2O2 and a molecular weight of 272.35 g/mol. Its IUPAC name is 6-(3-ethylphenoxy)-2-propan-2-yloxypyridin-3-amine.

Molecular Properties

Compound Name6-(3-ethylphenoxy)-2-propan-2-yloxypyridin-3-amine
PubChem CID43262374
Molecular FormulaC16H20N2O2
Molecular Weight272.35 g/mol
Exact Mass272.15
IUPAC Name6-(3-ethylphenoxy)-2-propan-2-yloxypyridin-3-amine
SMILESCCc1cccc(Oc2ccc(N)c(OC(C)C)n2)c1
InChIInChI=1S/C16H20N2O2/c1-4-12-6-5-7-13(10-12)20-15-9-8-14(17)16(18-15)19-11(2)3/h5-11H,4,17H2,1-3H3
InChIKeyTZCDRYRFERCHRE-UHFFFAOYSA-N
XLogP3.81
TPSA57.37 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms20
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500272.35
LogP ≤ 53.81
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of 6-(3-ethylphenoxy)-2-propan-2-yloxypyridin-3-amine?
The IUPAC name of 6-(3-ethylphenoxy)-2-propan-2-yloxypyridin-3-amine (CID 43262374) is 6-(3-ethylphenoxy)-2-propan-2-yloxypyridin-3-amine.
What is the SMILES notation for 6-(3-ethylphenoxy)-2-propan-2-yloxypyridin-3-amine?
The canonical SMILES for 6-(3-ethylphenoxy)-2-propan-2-yloxypyridin-3-amine is CCc1cccc(Oc2ccc(N)c(OC(C)C)n2)c1.
What is the InChIKey of 6-(3-ethylphenoxy)-2-propan-2-yloxypyridin-3-amine?
The InChIKey is TZCDRYRFERCHRE-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H20N2O2/c1-4-12-6-5-7-13(10-12)20-15-9-8-14(17)16(18-15)19-11(2)3/h5-11H,4,17H2,1-3H3.
What are the key properties of 6-(3-ethylphenoxy)-2-propan-2-yloxypyridin-3-amine?
6-(3-ethylphenoxy)-2-propan-2-yloxypyridin-3-amine has a molecular weight of 272.35 g/mol, XLogP of 3.81, 5 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 6-(3-ethylphenoxy)-2-propan-2-yloxypyridin-3-amine is sourced from PubChem (CID 43262374), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).