2-methyl-6-(3-propan-2-ylphenoxy)pyridin-3-amine

C15H18N2O — CID 79020672

IUPAC2-methyl-6-(3-propan-2-ylphenoxy)pyridin-3-amine
SMILESCc1nc(Oc2cccc(C(C)C)c2)ccc1N
InChIInChI=1S/C15H18N2O/c1-10(2)12-5-4-6-13(9-12)18-15-8-7-14(16)11(3)17-15/h4-10H,16H2,1-3H3
InChIKeyCKTHGQWYNSCEIH-UHFFFAOYSA-N
MW242.32 g/mol
LogP3.89
Rot. Bonds3

About 2-methyl-6-(3-propan-2-ylphenoxy)pyridin-3-amine

2-methyl-6-(3-propan-2-ylphenoxy)pyridin-3-amine (PubChem CID 79020672) has the molecular formula C15H18N2O and a molecular weight of 242.32 g/mol. Its IUPAC name is 2-methyl-6-(3-propan-2-ylphenoxy)pyridin-3-amine.

Molecular Properties

Compound Name2-methyl-6-(3-propan-2-ylphenoxy)pyridin-3-amine
PubChem CID79020672
Molecular FormulaC15H18N2O
Molecular Weight242.32 g/mol
Exact Mass242.14
IUPAC Name2-methyl-6-(3-propan-2-ylphenoxy)pyridin-3-amine
SMILESCc1nc(Oc2cccc(C(C)C)c2)ccc1N
InChIInChI=1S/C15H18N2O/c1-10(2)12-5-4-6-13(9-12)18-15-8-7-14(16)11(3)17-15/h4-10H,16H2,1-3H3
InChIKeyCKTHGQWYNSCEIH-UHFFFAOYSA-N
XLogP3.89
TPSA48.14 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms18
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500242.32
LogP ≤ 53.89
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 2-methyl-6-(3-propan-2-ylphenoxy)pyridin-3-amine?
The IUPAC name of 2-methyl-6-(3-propan-2-ylphenoxy)pyridin-3-amine (CID 79020672) is 2-methyl-6-(3-propan-2-ylphenoxy)pyridin-3-amine.
What is the SMILES notation for 2-methyl-6-(3-propan-2-ylphenoxy)pyridin-3-amine?
The canonical SMILES for 2-methyl-6-(3-propan-2-ylphenoxy)pyridin-3-amine is Cc1nc(Oc2cccc(C(C)C)c2)ccc1N.
What is the InChIKey of 2-methyl-6-(3-propan-2-ylphenoxy)pyridin-3-amine?
The InChIKey is CKTHGQWYNSCEIH-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H18N2O/c1-10(2)12-5-4-6-13(9-12)18-15-8-7-14(16)11(3)17-15/h4-10H,16H2,1-3H3.
What are the key properties of 2-methyl-6-(3-propan-2-ylphenoxy)pyridin-3-amine?
2-methyl-6-(3-propan-2-ylphenoxy)pyridin-3-amine has a molecular weight of 242.32 g/mol, XLogP of 3.89, 3 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-methyl-6-(3-propan-2-ylphenoxy)pyridin-3-amine is sourced from PubChem (CID 79020672), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).