4-(3,4-dimethylphenoxy)pyridin-3-amine

C13H14N2O — CID 28890163

IUPAC4-(3,4-dimethylphenoxy)pyridin-3-amine
SMILESCc1ccc(Oc2ccncc2N)cc1C
InChIInChI=1S/C13H14N2O/c1-9-3-4-11(7-10(9)2)16-13-5-6-15-8-12(13)14/h3-8H,14H2,1-2H3
InChIKeyKXHWDQNIXAQJOE-UHFFFAOYSA-N
MW214.27 g/mol
LogP3.07
Rot. Bonds2

About 4-(3,4-dimethylphenoxy)pyridin-3-amine

4-(3,4-dimethylphenoxy)pyridin-3-amine (PubChem CID 28890163) has the molecular formula C13H14N2O and a molecular weight of 214.27 g/mol. Its IUPAC name is 4-(3,4-dimethylphenoxy)pyridin-3-amine.

Molecular Properties

Compound Name4-(3,4-dimethylphenoxy)pyridin-3-amine
PubChem CID28890163
Molecular FormulaC13H14N2O
Molecular Weight214.27 g/mol
Exact Mass214.11
IUPAC Name4-(3,4-dimethylphenoxy)pyridin-3-amine
SMILESCc1ccc(Oc2ccncc2N)cc1C
InChIInChI=1S/C13H14N2O/c1-9-3-4-11(7-10(9)2)16-13-5-6-15-8-12(13)14/h3-8H,14H2,1-2H3
InChIKeyKXHWDQNIXAQJOE-UHFFFAOYSA-N
XLogP3.07
TPSA48.14 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500214.27
LogP ≤ 53.07
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 4-(3,4-dimethylphenoxy)pyridin-3-amine?
The IUPAC name of 4-(3,4-dimethylphenoxy)pyridin-3-amine (CID 28890163) is 4-(3,4-dimethylphenoxy)pyridin-3-amine.
What is the SMILES notation for 4-(3,4-dimethylphenoxy)pyridin-3-amine?
The canonical SMILES for 4-(3,4-dimethylphenoxy)pyridin-3-amine is Cc1ccc(Oc2ccncc2N)cc1C.
What is the InChIKey of 4-(3,4-dimethylphenoxy)pyridin-3-amine?
The InChIKey is KXHWDQNIXAQJOE-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H14N2O/c1-9-3-4-11(7-10(9)2)16-13-5-6-15-8-12(13)14/h3-8H,14H2,1-2H3.
What are the key properties of 4-(3,4-dimethylphenoxy)pyridin-3-amine?
4-(3,4-dimethylphenoxy)pyridin-3-amine has a molecular weight of 214.27 g/mol, XLogP of 3.07, 2 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 4-(3,4-dimethylphenoxy)pyridin-3-amine is sourced from PubChem (CID 28890163), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).