6-(2,3-dimethylphenoxy)-2-[(2-methylpropan-2-yl)oxy]pyridin-3-amine

C17H22N2O2 — CID 43262022

IUPAC6-(2,3-dimethylphenoxy)-2-[(2-methylpropan-2-yl)oxy]pyridin-3-amine
SMILESCc1cccc(Oc2ccc(N)c(OC(C)(C)C)n2)c1C
InChIInChI=1S/C17H22N2O2/c1-11-7-6-8-14(12(11)2)20-15-10-9-13(18)16(19-15)21-17(3,4)5/h6-10H,18H2,1-5H3
InChIKeyQZNQDOQKLVTHHF-UHFFFAOYSA-N
MW286.38 g/mol
LogP4.25
Rot. Bonds3

About 6-(2,3-dimethylphenoxy)-2-[(2-methylpropan-2-yl)oxy]pyridin-3-amine

6-(2,3-dimethylphenoxy)-2-[(2-methylpropan-2-yl)oxy]pyridin-3-amine (PubChem CID 43262022) has the molecular formula C17H22N2O2 and a molecular weight of 286.38 g/mol. Its IUPAC name is 6-(2,3-dimethylphenoxy)-2-[(2-methylpropan-2-yl)oxy]pyridin-3-amine.

Molecular Properties

Compound Name6-(2,3-dimethylphenoxy)-2-[(2-methylpropan-2-yl)oxy]pyridin-3-amine
PubChem CID43262022
Molecular FormulaC17H22N2O2
Molecular Weight286.38 g/mol
Exact Mass286.17
IUPAC Name6-(2,3-dimethylphenoxy)-2-[(2-methylpropan-2-yl)oxy]pyridin-3-amine
SMILESCc1cccc(Oc2ccc(N)c(OC(C)(C)C)n2)c1C
InChIInChI=1S/C17H22N2O2/c1-11-7-6-8-14(12(11)2)20-15-10-9-13(18)16(19-15)21-17(3,4)5/h6-10H,18H2,1-5H3
InChIKeyQZNQDOQKLVTHHF-UHFFFAOYSA-N
XLogP4.25
TPSA57.37 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms21
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500286.38
LogP ≤ 54.25
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of 6-(2,3-dimethylphenoxy)-2-[(2-methylpropan-2-yl)oxy]pyridin-3-amine?
The IUPAC name of 6-(2,3-dimethylphenoxy)-2-[(2-methylpropan-2-yl)oxy]pyridin-3-amine (CID 43262022) is 6-(2,3-dimethylphenoxy)-2-[(2-methylpropan-2-yl)oxy]pyridin-3-amine.
What is the SMILES notation for 6-(2,3-dimethylphenoxy)-2-[(2-methylpropan-2-yl)oxy]pyridin-3-amine?
The canonical SMILES for 6-(2,3-dimethylphenoxy)-2-[(2-methylpropan-2-yl)oxy]pyridin-3-amine is Cc1cccc(Oc2ccc(N)c(OC(C)(C)C)n2)c1C.
What is the InChIKey of 6-(2,3-dimethylphenoxy)-2-[(2-methylpropan-2-yl)oxy]pyridin-3-amine?
The InChIKey is QZNQDOQKLVTHHF-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H22N2O2/c1-11-7-6-8-14(12(11)2)20-15-10-9-13(18)16(19-15)21-17(3,4)5/h6-10H,18H2,1-5H3.
What are the key properties of 6-(2,3-dimethylphenoxy)-2-[(2-methylpropan-2-yl)oxy]pyridin-3-amine?
6-(2,3-dimethylphenoxy)-2-[(2-methylpropan-2-yl)oxy]pyridin-3-amine has a molecular weight of 286.38 g/mol, XLogP of 4.25, 3 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 6-(2,3-dimethylphenoxy)-2-[(2-methylpropan-2-yl)oxy]pyridin-3-amine is sourced from PubChem (CID 43262022), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).