6-(4-methylphenoxy)-2-[(2-methylpropan-2-yl)oxy]pyridin-3-amine

C16H20N2O2 — CID 43262208

IUPAC6-(4-methylphenoxy)-2-[(2-methylpropan-2-yl)oxy]pyridin-3-amine
SMILESCc1ccc(Oc2ccc(N)c(OC(C)(C)C)n2)cc1
InChIInChI=1S/C16H20N2O2/c1-11-5-7-12(8-6-11)19-14-10-9-13(17)15(18-14)20-16(2,3)4/h5-10H,17H2,1-4H3
InChIKeyOGCJWBBDDYMZGS-UHFFFAOYSA-N
MW272.35 g/mol
LogP3.94
Rot. Bonds3

About 6-(4-methylphenoxy)-2-[(2-methylpropan-2-yl)oxy]pyridin-3-amine

6-(4-methylphenoxy)-2-[(2-methylpropan-2-yl)oxy]pyridin-3-amine (PubChem CID 43262208) has the molecular formula C16H20N2O2 and a molecular weight of 272.35 g/mol. Its IUPAC name is 6-(4-methylphenoxy)-2-[(2-methylpropan-2-yl)oxy]pyridin-3-amine.

Molecular Properties

Compound Name6-(4-methylphenoxy)-2-[(2-methylpropan-2-yl)oxy]pyridin-3-amine
PubChem CID43262208
Molecular FormulaC16H20N2O2
Molecular Weight272.35 g/mol
Exact Mass272.15
IUPAC Name6-(4-methylphenoxy)-2-[(2-methylpropan-2-yl)oxy]pyridin-3-amine
SMILESCc1ccc(Oc2ccc(N)c(OC(C)(C)C)n2)cc1
InChIInChI=1S/C16H20N2O2/c1-11-5-7-12(8-6-11)19-14-10-9-13(17)15(18-14)20-16(2,3)4/h5-10H,17H2,1-4H3
InChIKeyOGCJWBBDDYMZGS-UHFFFAOYSA-N
XLogP3.94
TPSA57.37 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms20
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500272.35
LogP ≤ 53.94
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of 6-(4-methylphenoxy)-2-[(2-methylpropan-2-yl)oxy]pyridin-3-amine?
The IUPAC name of 6-(4-methylphenoxy)-2-[(2-methylpropan-2-yl)oxy]pyridin-3-amine (CID 43262208) is 6-(4-methylphenoxy)-2-[(2-methylpropan-2-yl)oxy]pyridin-3-amine.
What is the SMILES notation for 6-(4-methylphenoxy)-2-[(2-methylpropan-2-yl)oxy]pyridin-3-amine?
The canonical SMILES for 6-(4-methylphenoxy)-2-[(2-methylpropan-2-yl)oxy]pyridin-3-amine is Cc1ccc(Oc2ccc(N)c(OC(C)(C)C)n2)cc1.
What is the InChIKey of 6-(4-methylphenoxy)-2-[(2-methylpropan-2-yl)oxy]pyridin-3-amine?
The InChIKey is OGCJWBBDDYMZGS-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H20N2O2/c1-11-5-7-12(8-6-11)19-14-10-9-13(17)15(18-14)20-16(2,3)4/h5-10H,17H2,1-4H3.
What are the key properties of 6-(4-methylphenoxy)-2-[(2-methylpropan-2-yl)oxy]pyridin-3-amine?
6-(4-methylphenoxy)-2-[(2-methylpropan-2-yl)oxy]pyridin-3-amine has a molecular weight of 272.35 g/mol, XLogP of 3.94, 3 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 6-(4-methylphenoxy)-2-[(2-methylpropan-2-yl)oxy]pyridin-3-amine is sourced from PubChem (CID 43262208), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).