6-(2-propan-2-yloxyphenoxy)pyridin-3-amine

C14H16N2O2 — CID 2800141

IUPAC6-(2-propan-2-yloxyphenoxy)pyridin-3-amine
SMILESCC(C)Oc1ccccc1Oc1ccc(N)cn1
InChIInChI=1S/C14H16N2O2/c1-10(2)17-12-5-3-4-6-13(12)18-14-8-7-11(15)9-16-14/h3-10H,15H2,1-2H3
InChIKeyXWDDOSOCPTUYHK-UHFFFAOYSA-N
MW244.29 g/mol
LogP3.24
Rot. Bonds4

About 6-(2-propan-2-yloxyphenoxy)pyridin-3-amine

6-(2-propan-2-yloxyphenoxy)pyridin-3-amine (PubChem CID 2800141) has the molecular formula C14H16N2O2 and a molecular weight of 244.29 g/mol. Its IUPAC name is 6-(2-propan-2-yloxyphenoxy)pyridin-3-amine.

Molecular Properties

Compound Name6-(2-propan-2-yloxyphenoxy)pyridin-3-amine
PubChem CID2800141
Molecular FormulaC14H16N2O2
Molecular Weight244.29 g/mol
Exact Mass244.12
IUPAC Name6-(2-propan-2-yloxyphenoxy)pyridin-3-amine
SMILESCC(C)Oc1ccccc1Oc1ccc(N)cn1
InChIInChI=1S/C14H16N2O2/c1-10(2)17-12-5-3-4-6-13(12)18-14-8-7-11(15)9-16-14/h3-10H,15H2,1-2H3
InChIKeyXWDDOSOCPTUYHK-UHFFFAOYSA-N
XLogP3.24
TPSA57.37 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500244.29
LogP ≤ 53.24
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'anil_OC_no_alk_A(8)', 'substructure': 'N/A'}

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Frequently Asked Questions

What is the IUPAC name of 6-(2-propan-2-yloxyphenoxy)pyridin-3-amine?
The IUPAC name of 6-(2-propan-2-yloxyphenoxy)pyridin-3-amine (CID 2800141) is 6-(2-propan-2-yloxyphenoxy)pyridin-3-amine.
What is the SMILES notation for 6-(2-propan-2-yloxyphenoxy)pyridin-3-amine?
The canonical SMILES for 6-(2-propan-2-yloxyphenoxy)pyridin-3-amine is CC(C)Oc1ccccc1Oc1ccc(N)cn1.
What is the InChIKey of 6-(2-propan-2-yloxyphenoxy)pyridin-3-amine?
The InChIKey is XWDDOSOCPTUYHK-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H16N2O2/c1-10(2)17-12-5-3-4-6-13(12)18-14-8-7-11(15)9-16-14/h3-10H,15H2,1-2H3.
What are the key properties of 6-(2-propan-2-yloxyphenoxy)pyridin-3-amine?
6-(2-propan-2-yloxyphenoxy)pyridin-3-amine has a molecular weight of 244.29 g/mol, XLogP of 3.24, 4 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 6-(2-propan-2-yloxyphenoxy)pyridin-3-amine is sourced from PubChem (CID 2800141), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).