6-(2-methoxyethoxy)-N-[(6-methoxy-2-pyridinyl)methyl]pyridin-3-amine

C15H19N3O3 — CID 103347504

IUPAC6-(2-methoxyethoxy)-N-[(6-methoxy-2-pyridinyl)methyl]pyridin-3-amine
SMILESCOCCOc1ccc(NCc2cccc(OC)n2)cn1
InChIInChI=1S/C15H19N3O3/c1-19-8-9-21-14-7-6-12(10-17-14)16-11-13-4-3-5-15(18-13)20-2/h3-7,10,16H,8-9,11H2,1-2H3
InChIKeyNWPPLBMZIWFCPX-UHFFFAOYSA-N
MW289.34 g/mol
LogP2.12
Rot. Bonds8

About 6-(2-methoxyethoxy)-N-[(6-methoxy-2-pyridinyl)methyl]pyridin-3-amine

6-(2-methoxyethoxy)-N-[(6-methoxy-2-pyridinyl)methyl]pyridin-3-amine (PubChem CID 103347504) has the molecular formula C15H19N3O3 and a molecular weight of 289.34 g/mol. Its IUPAC name is 6-(2-methoxyethoxy)-N-[(6-methoxy-2-pyridinyl)methyl]pyridin-3-amine.

Molecular Properties

Compound Name6-(2-methoxyethoxy)-N-[(6-methoxy-2-pyridinyl)methyl]pyridin-3-amine
PubChem CID103347504
Molecular FormulaC15H19N3O3
Molecular Weight289.34 g/mol
Exact Mass289.14
IUPAC Name6-(2-methoxyethoxy)-N-[(6-methoxy-2-pyridinyl)methyl]pyridin-3-amine
SMILESCOCCOc1ccc(NCc2cccc(OC)n2)cn1
InChIInChI=1S/C15H19N3O3/c1-19-8-9-21-14-7-6-12(10-17-14)16-11-13-4-3-5-15(18-13)20-2/h3-7,10,16H,8-9,11H2,1-2H3
InChIKeyNWPPLBMZIWFCPX-UHFFFAOYSA-N
XLogP2.12
TPSA65.50 Ų
H-Bond Donors1
H-Bond Acceptors6
Rotatable Bonds8
Heavy Atoms21
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500289.34
LogP ≤ 52.12
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 6-(2-methoxyethoxy)-N-[(6-methoxy-2-pyridinyl)methyl]pyridin-3-amine?
The IUPAC name of 6-(2-methoxyethoxy)-N-[(6-methoxy-2-pyridinyl)methyl]pyridin-3-amine (CID 103347504) is 6-(2-methoxyethoxy)-N-[(6-methoxy-2-pyridinyl)methyl]pyridin-3-amine.
What is the SMILES notation for 6-(2-methoxyethoxy)-N-[(6-methoxy-2-pyridinyl)methyl]pyridin-3-amine?
The canonical SMILES for 6-(2-methoxyethoxy)-N-[(6-methoxy-2-pyridinyl)methyl]pyridin-3-amine is COCCOc1ccc(NCc2cccc(OC)n2)cn1.
What is the InChIKey of 6-(2-methoxyethoxy)-N-[(6-methoxy-2-pyridinyl)methyl]pyridin-3-amine?
The InChIKey is NWPPLBMZIWFCPX-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H19N3O3/c1-19-8-9-21-14-7-6-12(10-17-14)16-11-13-4-3-5-15(18-13)20-2/h3-7,10,16H,8-9,11H2,1-2H3.
What are the key properties of 6-(2-methoxyethoxy)-N-[(6-methoxy-2-pyridinyl)methyl]pyridin-3-amine?
6-(2-methoxyethoxy)-N-[(6-methoxy-2-pyridinyl)methyl]pyridin-3-amine has a molecular weight of 289.34 g/mol, XLogP of 2.12, 8 rotatable bonds, 1 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 6-(2-methoxyethoxy)-N-[(6-methoxy-2-pyridinyl)methyl]pyridin-3-amine is sourced from PubChem (CID 103347504), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).