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

C19H18FN3O — CID 11267265

IUPAC3-ethoxy-5-(3-fluorophenyl)-N-(6-methyl-2-pyridinyl)pyridin-2-amine
SMILESCCOc1cc(-c2cccc(F)c2)cnc1Nc1cccc(C)n1
InChIInChI=1S/C19H18FN3O/c1-3-24-17-11-15(14-7-5-8-16(20)10-14)12-21-19(17)23-18-9-4-6-13(2)22-18/h4-12H,3H2,1-2H3,(H,21,22,23)
InChIKeyIPDVTRZYAHHNMH-UHFFFAOYSA-N
MW323.37 g/mol
LogP4.73
Rot. Bonds5

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

3-ethoxy-5-(3-fluorophenyl)-N-(6-methyl-2-pyridinyl)pyridin-2-amine (PubChem CID 11267265) has the molecular formula C19H18FN3O and a molecular weight of 323.37 g/mol. Its IUPAC name is 3-ethoxy-5-(3-fluorophenyl)-N-(6-methyl-2-pyridinyl)pyridin-2-amine.

Molecular Properties

Compound Name3-ethoxy-5-(3-fluorophenyl)-N-(6-methyl-2-pyridinyl)pyridin-2-amine
PubChem CID11267265
Molecular FormulaC19H18FN3O
Molecular Weight323.37 g/mol
Exact Mass323.14
IUPAC Name3-ethoxy-5-(3-fluorophenyl)-N-(6-methyl-2-pyridinyl)pyridin-2-amine
SMILESCCOc1cc(-c2cccc(F)c2)cnc1Nc1cccc(C)n1
InChIInChI=1S/C19H18FN3O/c1-3-24-17-11-15(14-7-5-8-16(20)10-14)12-21-19(17)23-18-9-4-6-13(2)22-18/h4-12H,3H2,1-2H3,(H,21,22,23)
InChIKeyIPDVTRZYAHHNMH-UHFFFAOYSA-N
XLogP4.73
TPSA47.04 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500323.37
LogP ≤ 54.73
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of 3-ethoxy-5-(3-fluorophenyl)-N-(6-methyl-2-pyridinyl)pyridin-2-amine?
The IUPAC name of 3-ethoxy-5-(3-fluorophenyl)-N-(6-methyl-2-pyridinyl)pyridin-2-amine (CID 11267265) is 3-ethoxy-5-(3-fluorophenyl)-N-(6-methyl-2-pyridinyl)pyridin-2-amine.
What is the SMILES notation for 3-ethoxy-5-(3-fluorophenyl)-N-(6-methyl-2-pyridinyl)pyridin-2-amine?
The canonical SMILES for 3-ethoxy-5-(3-fluorophenyl)-N-(6-methyl-2-pyridinyl)pyridin-2-amine is CCOc1cc(-c2cccc(F)c2)cnc1Nc1cccc(C)n1.
What is the InChIKey of 3-ethoxy-5-(3-fluorophenyl)-N-(6-methyl-2-pyridinyl)pyridin-2-amine?
The InChIKey is IPDVTRZYAHHNMH-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H18FN3O/c1-3-24-17-11-15(14-7-5-8-16(20)10-14)12-21-19(17)23-18-9-4-6-13(2)22-18/h4-12H,3H2,1-2H3,(H,21,22,23).
What are the key properties of 3-ethoxy-5-(3-fluorophenyl)-N-(6-methyl-2-pyridinyl)pyridin-2-amine?
3-ethoxy-5-(3-fluorophenyl)-N-(6-methyl-2-pyridinyl)pyridin-2-amine has a molecular weight of 323.37 g/mol, XLogP of 4.73, 5 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 3-ethoxy-5-(3-fluorophenyl)-N-(6-methyl-2-pyridinyl)pyridin-2-amine is sourced from PubChem (CID 11267265), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).