6-(3,4-dimethylphenoxy)pyridin-3-amine

C13H14N2O — CID 16787193

IUPAC6-(3,4-dimethylphenoxy)pyridin-3-amine
SMILESCc1ccc(Oc2ccc(N)cn2)cc1C
InChIInChI=1S/C13H14N2O/c1-9-3-5-12(7-10(9)2)16-13-6-4-11(14)8-15-13/h3-8H,14H2,1-2H3
InChIKeyUTMLYKHXAYVJFU-UHFFFAOYSA-N
MW214.27 g/mol
LogP3.07
Rot. Bonds2

About 6-(3,4-dimethylphenoxy)pyridin-3-amine

6-(3,4-dimethylphenoxy)pyridin-3-amine (PubChem CID 16787193) has the molecular formula C13H14N2O and a molecular weight of 214.27 g/mol. Its IUPAC name is 6-(3,4-dimethylphenoxy)pyridin-3-amine.

Molecular Properties

Compound Name6-(3,4-dimethylphenoxy)pyridin-3-amine
PubChem CID16787193
Molecular FormulaC13H14N2O
Molecular Weight214.27 g/mol
Exact Mass214.11
IUPAC Name6-(3,4-dimethylphenoxy)pyridin-3-amine
SMILESCc1ccc(Oc2ccc(N)cn2)cc1C
InChIInChI=1S/C13H14N2O/c1-9-3-5-12(7-10(9)2)16-13-6-4-11(14)8-15-13/h3-8H,14H2,1-2H3
InChIKeyUTMLYKHXAYVJFU-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

Computed Properties (RDKit)

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

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Related Compounds

2-(3,4-dimethylphenoxy)-5-methylpyridine
CID 123670346
6-[4-[(5-amino-2-pyridinyl)oxy]phenoxy]pyridin-3-amine
CID 102449756
1-[4-[(5-amino-2-pyridinyl)oxy]-2-methylphenyl]ethanone
CID 18673901
6-(4-methylphenoxy)pyridin-3-amine
CID 4763818
6-(3,4-dimethylphenoxy)-4-methylpyridin-3-amine
CID 79021050
6-(3,5-dimethoxyphenoxy)pyridin-3-amine
CID 43589800
6-(3-methoxyphenoxy)pyridin-3-amine
CID 806744
5-[4-[(5-amino-2-pyridinyl)oxy]phenyl]-4-methylpyridin-2-amine
CID 162628374
6-(5-bromo-2-methylphenoxy)pyridin-3-amine
CID 107283348
6-(5-fluoro-2-methylphenoxy)pyridin-3-amine
CID 102980228
6-(3-fluorophenoxy)pyridin-3-amine
CID 16789868
1-[4-[(5-amino-2-pyridinyl)oxy]phenyl]ethanone
CID 18673928

Frequently Asked Questions

What is the IUPAC name of 6-(3,4-dimethylphenoxy)pyridin-3-amine?
The IUPAC name of 6-(3,4-dimethylphenoxy)pyridin-3-amine (CID 16787193) is 6-(3,4-dimethylphenoxy)pyridin-3-amine.
What is the SMILES notation for 6-(3,4-dimethylphenoxy)pyridin-3-amine?
The canonical SMILES for 6-(3,4-dimethylphenoxy)pyridin-3-amine is Cc1ccc(Oc2ccc(N)cn2)cc1C.
What is the InChIKey of 6-(3,4-dimethylphenoxy)pyridin-3-amine?
The InChIKey is UTMLYKHXAYVJFU-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H14N2O/c1-9-3-5-12(7-10(9)2)16-13-6-4-11(14)8-15-13/h3-8H,14H2,1-2H3.
What are the key properties of 6-(3,4-dimethylphenoxy)pyridin-3-amine?
6-(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 6-(3,4-dimethylphenoxy)pyridin-3-amine is sourced from PubChem (CID 16787193), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).