3-(2-methoxyethoxy)-5-phenoxy-N-pyridin-2-ylpyridin-2-amine

C19H19N3O3 — CID 25261507

IUPAC3-(2-methoxyethoxy)-5-phenoxy-N-pyridin-2-ylpyridin-2-amine
SMILESCOCCOc1cc(Oc2ccccc2)cnc1Nc1ccccn1
InChIInChI=1S/C19H19N3O3/c1-23-11-12-24-17-13-16(25-15-7-3-2-4-8-15)14-21-19(17)22-18-9-5-6-10-20-18/h2-10,13-14H,11-12H2,1H3,(H,20,21,22)
InChIKeyYWCCONZHFAIOPE-UHFFFAOYSA-N
MW337.38 g/mol
LogP4.04
Rot. Bonds8

About 3-(2-methoxyethoxy)-5-phenoxy-N-pyridin-2-ylpyridin-2-amine

3-(2-methoxyethoxy)-5-phenoxy-N-pyridin-2-ylpyridin-2-amine (PubChem CID 25261507) has the molecular formula C19H19N3O3 and a molecular weight of 337.38 g/mol. Its IUPAC name is 3-(2-methoxyethoxy)-5-phenoxy-N-pyridin-2-ylpyridin-2-amine.

Molecular Properties

Compound Name3-(2-methoxyethoxy)-5-phenoxy-N-pyridin-2-ylpyridin-2-amine
PubChem CID25261507
Molecular FormulaC19H19N3O3
Molecular Weight337.38 g/mol
Exact Mass337.14
IUPAC Name3-(2-methoxyethoxy)-5-phenoxy-N-pyridin-2-ylpyridin-2-amine
SMILESCOCCOc1cc(Oc2ccccc2)cnc1Nc1ccccn1
InChIInChI=1S/C19H19N3O3/c1-23-11-12-24-17-13-16(25-15-7-3-2-4-8-15)14-21-19(17)22-18-9-5-6-10-20-18/h2-10,13-14H,11-12H2,1H3,(H,20,21,22)
InChIKeyYWCCONZHFAIOPE-UHFFFAOYSA-N
XLogP4.04
TPSA65.50 Ų
H-Bond Donors1
H-Bond Acceptors6
Rotatable Bonds8
Heavy Atoms25
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500337.38
LogP ≤ 54.04
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 106

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Aliphatic_long_chain', 'substructure': 'N/A'}

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Frequently Asked Questions

What is the IUPAC name of 3-(2-methoxyethoxy)-5-phenoxy-N-pyridin-2-ylpyridin-2-amine?
The IUPAC name of 3-(2-methoxyethoxy)-5-phenoxy-N-pyridin-2-ylpyridin-2-amine (CID 25261507) is 3-(2-methoxyethoxy)-5-phenoxy-N-pyridin-2-ylpyridin-2-amine.
What is the SMILES notation for 3-(2-methoxyethoxy)-5-phenoxy-N-pyridin-2-ylpyridin-2-amine?
The canonical SMILES for 3-(2-methoxyethoxy)-5-phenoxy-N-pyridin-2-ylpyridin-2-amine is COCCOc1cc(Oc2ccccc2)cnc1Nc1ccccn1.
What is the InChIKey of 3-(2-methoxyethoxy)-5-phenoxy-N-pyridin-2-ylpyridin-2-amine?
The InChIKey is YWCCONZHFAIOPE-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H19N3O3/c1-23-11-12-24-17-13-16(25-15-7-3-2-4-8-15)14-21-19(17)22-18-9-5-6-10-20-18/h2-10,13-14H,11-12H2,1H3,(H,20,21,22).
What are the key properties of 3-(2-methoxyethoxy)-5-phenoxy-N-pyridin-2-ylpyridin-2-amine?
3-(2-methoxyethoxy)-5-phenoxy-N-pyridin-2-ylpyridin-2-amine has a molecular weight of 337.38 g/mol, XLogP of 4.04, 8 rotatable bonds, 1 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 3-(2-methoxyethoxy)-5-phenoxy-N-pyridin-2-ylpyridin-2-amine is sourced from PubChem (CID 25261507), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).