3-ethoxy-N-(6-methyl-2-pyridinyl)-5-pyridin-2-ylpyridin-2-amine

C18H18N4O — CID 11220495

IUPAC3-ethoxy-N-(6-methyl-2-pyridinyl)-5-pyridin-2-ylpyridin-2-amine
SMILESCCOc1cc(-c2ccccn2)cnc1Nc1cccc(C)n1
InChIInChI=1S/C18H18N4O/c1-3-23-16-11-14(15-8-4-5-10-19-15)12-20-18(16)22-17-9-6-7-13(2)21-17/h4-12H,3H2,1-2H3,(H,20,21,22)
InChIKeyGZZWOVOSKRZICU-UHFFFAOYSA-N
MW306.37 g/mol
LogP3.99
Rot. Bonds5

About 3-ethoxy-N-(6-methyl-2-pyridinyl)-5-pyridin-2-ylpyridin-2-amine

3-ethoxy-N-(6-methyl-2-pyridinyl)-5-pyridin-2-ylpyridin-2-amine (PubChem CID 11220495) has the molecular formula C18H18N4O and a molecular weight of 306.37 g/mol. Its IUPAC name is 3-ethoxy-N-(6-methyl-2-pyridinyl)-5-pyridin-2-ylpyridin-2-amine.

Molecular Properties

Compound Name3-ethoxy-N-(6-methyl-2-pyridinyl)-5-pyridin-2-ylpyridin-2-amine
PubChem CID11220495
Molecular FormulaC18H18N4O
Molecular Weight306.37 g/mol
Exact Mass306.15
IUPAC Name3-ethoxy-N-(6-methyl-2-pyridinyl)-5-pyridin-2-ylpyridin-2-amine
SMILESCCOc1cc(-c2ccccn2)cnc1Nc1cccc(C)n1
InChIInChI=1S/C18H18N4O/c1-3-23-16-11-14(15-8-4-5-10-19-15)12-20-18(16)22-17-9-6-7-13(2)21-17/h4-12H,3H2,1-2H3,(H,20,21,22)
InChIKeyGZZWOVOSKRZICU-UHFFFAOYSA-N
XLogP3.99
TPSA59.93 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds5
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500306.37
LogP ≤ 53.99
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Frequently Asked Questions

What is the IUPAC name of 3-ethoxy-N-(6-methyl-2-pyridinyl)-5-pyridin-2-ylpyridin-2-amine?
The IUPAC name of 3-ethoxy-N-(6-methyl-2-pyridinyl)-5-pyridin-2-ylpyridin-2-amine (CID 11220495) is 3-ethoxy-N-(6-methyl-2-pyridinyl)-5-pyridin-2-ylpyridin-2-amine.
What is the SMILES notation for 3-ethoxy-N-(6-methyl-2-pyridinyl)-5-pyridin-2-ylpyridin-2-amine?
The canonical SMILES for 3-ethoxy-N-(6-methyl-2-pyridinyl)-5-pyridin-2-ylpyridin-2-amine is CCOc1cc(-c2ccccn2)cnc1Nc1cccc(C)n1.
What is the InChIKey of 3-ethoxy-N-(6-methyl-2-pyridinyl)-5-pyridin-2-ylpyridin-2-amine?
The InChIKey is GZZWOVOSKRZICU-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H18N4O/c1-3-23-16-11-14(15-8-4-5-10-19-15)12-20-18(16)22-17-9-6-7-13(2)21-17/h4-12H,3H2,1-2H3,(H,20,21,22).
What are the key properties of 3-ethoxy-N-(6-methyl-2-pyridinyl)-5-pyridin-2-ylpyridin-2-amine?
3-ethoxy-N-(6-methyl-2-pyridinyl)-5-pyridin-2-ylpyridin-2-amine has a molecular weight of 306.37 g/mol, XLogP of 3.99, 5 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 3-ethoxy-N-(6-methyl-2-pyridinyl)-5-pyridin-2-ylpyridin-2-amine is sourced from PubChem (CID 11220495), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).