6-[4-[(5-amino-2-pyridinyl)oxy]phenoxy]pyridin-3-amine

C16H14N4O2 — CID 102449756

IUPAC6-[4-[(5-amino-2-pyridinyl)oxy]phenoxy]pyridin-3-amine
SMILESNc1ccc(Oc2ccc(Oc3ccc(N)cn3)cc2)nc1
InChIInChI=1S/C16H14N4O2/c17-11-1-7-15(19-9-11)21-13-3-5-14(6-4-13)22-16-8-2-12(18)10-20-16/h1-10H,17-18H2
InChIKeyAZFHHVKWKYHFFF-UHFFFAOYSA-N
MW294.31 g/mol
LogP3.23
Rot. Bonds4

About 6-[4-[(5-amino-2-pyridinyl)oxy]phenoxy]pyridin-3-amine

6-[4-[(5-amino-2-pyridinyl)oxy]phenoxy]pyridin-3-amine (PubChem CID 102449756) has the molecular formula C16H14N4O2 and a molecular weight of 294.31 g/mol. Its IUPAC name is 6-[4-[(5-amino-2-pyridinyl)oxy]phenoxy]pyridin-3-amine.

Molecular Properties

Compound Name6-[4-[(5-amino-2-pyridinyl)oxy]phenoxy]pyridin-3-amine
PubChem CID102449756
Molecular FormulaC16H14N4O2
Molecular Weight294.31 g/mol
Exact Mass294.11
IUPAC Name6-[4-[(5-amino-2-pyridinyl)oxy]phenoxy]pyridin-3-amine
SMILESNc1ccc(Oc2ccc(Oc3ccc(N)cn3)cc2)nc1
InChIInChI=1S/C16H14N4O2/c17-11-1-7-15(19-9-11)21-13-3-5-14(6-4-13)22-16-8-2-12(18)10-20-16/h1-10H,17-18H2
InChIKeyAZFHHVKWKYHFFF-UHFFFAOYSA-N
XLogP3.23
TPSA96.28 Ų
H-Bond Donors2
H-Bond Acceptors6
Rotatable Bonds4
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500294.31
LogP ≤ 53.23
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 106

Computed Properties (RDKit)

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

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Related Compounds

6-(4-methylphenoxy)pyridin-3-amine
CID 4763818
6-(4-benzylphenoxy)pyridin-3-amine
CID 62274041
1-[4-[(5-amino-2-pyridinyl)oxy]phenyl]ethanone
CID 18673928
6-(3,4-dimethylphenoxy)pyridin-3-amine
CID 16787193
6-(3,5-dimethoxyphenoxy)pyridin-3-amine
CID 43589800
6-[4-[(3,5-difluorophenyl)methoxy]phenoxy]pyridin-3-amine
CID 139794421
6-[(6-phenyl-3-pyridinyl)oxy]pyridin-3-amine
CID 155192033
5-[4-[(5-amino-2-pyridinyl)oxy]phenyl]-4-methylpyridin-2-amine
CID 162628374
6-(3-fluorophenoxy)pyridin-3-amine
CID 16789868
6-(3-methoxyphenoxy)pyridin-3-amine
CID 806744
6-[4-fluoro-3-(trifluoromethyl)phenoxy]pyridin-3-amine
CID 102746921
1-[4-[(5-amino-2-pyridinyl)oxy]-2-methylphenyl]ethanone
CID 18673901

Frequently Asked Questions

What is the IUPAC name of 6-[4-[(5-amino-2-pyridinyl)oxy]phenoxy]pyridin-3-amine?
The IUPAC name of 6-[4-[(5-amino-2-pyridinyl)oxy]phenoxy]pyridin-3-amine (CID 102449756) is 6-[4-[(5-amino-2-pyridinyl)oxy]phenoxy]pyridin-3-amine.
What is the SMILES notation for 6-[4-[(5-amino-2-pyridinyl)oxy]phenoxy]pyridin-3-amine?
The canonical SMILES for 6-[4-[(5-amino-2-pyridinyl)oxy]phenoxy]pyridin-3-amine is Nc1ccc(Oc2ccc(Oc3ccc(N)cn3)cc2)nc1.
What is the InChIKey of 6-[4-[(5-amino-2-pyridinyl)oxy]phenoxy]pyridin-3-amine?
The InChIKey is AZFHHVKWKYHFFF-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H14N4O2/c17-11-1-7-15(19-9-11)21-13-3-5-14(6-4-13)22-16-8-2-12(18)10-20-16/h1-10H,17-18H2.
What are the key properties of 6-[4-[(5-amino-2-pyridinyl)oxy]phenoxy]pyridin-3-amine?
6-[4-[(5-amino-2-pyridinyl)oxy]phenoxy]pyridin-3-amine has a molecular weight of 294.31 g/mol, XLogP of 3.23, 4 rotatable bonds, 2 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 6-[4-[(5-amino-2-pyridinyl)oxy]phenoxy]pyridin-3-amine is sourced from PubChem (CID 102449756), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).