2-N-(2-ethoxyphenyl)-6-methoxypyridine-2,5-diamine

C14H17N3O2 — CID 43261354

IUPAC2-N-(2-ethoxyphenyl)-6-methoxypyridine-2,5-diamine
SMILESCCOc1ccccc1Nc1ccc(N)c(OC)n1
InChIInChI=1S/C14H17N3O2/c1-3-19-12-7-5-4-6-11(12)16-13-9-8-10(15)14(17-13)18-2/h4-9H,3,15H2,1-2H3,(H,16,17)
InChIKeySTNBLVPNIMXLQY-UHFFFAOYSA-N
MW259.31 g/mol
LogP2.81
Rot. Bonds5

About 2-N-(2-ethoxyphenyl)-6-methoxypyridine-2,5-diamine

2-N-(2-ethoxyphenyl)-6-methoxypyridine-2,5-diamine (PubChem CID 43261354) has the molecular formula C14H17N3O2 and a molecular weight of 259.31 g/mol. Its IUPAC name is 2-N-(2-ethoxyphenyl)-6-methoxypyridine-2,5-diamine.

Molecular Properties

Compound Name2-N-(2-ethoxyphenyl)-6-methoxypyridine-2,5-diamine
PubChem CID43261354
Molecular FormulaC14H17N3O2
Molecular Weight259.31 g/mol
Exact Mass259.13
IUPAC Name2-N-(2-ethoxyphenyl)-6-methoxypyridine-2,5-diamine
SMILESCCOc1ccccc1Nc1ccc(N)c(OC)n1
InChIInChI=1S/C14H17N3O2/c1-3-19-12-7-5-4-6-11(12)16-13-9-8-10(15)14(17-13)18-2/h4-9H,3,15H2,1-2H3,(H,16,17)
InChIKeySTNBLVPNIMXLQY-UHFFFAOYSA-N
XLogP2.81
TPSA69.40 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds5
Heavy Atoms19
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500259.31
LogP ≤ 52.81
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

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Frequently Asked Questions

What is the IUPAC name of 2-N-(2-ethoxyphenyl)-6-methoxypyridine-2,5-diamine?
The IUPAC name of 2-N-(2-ethoxyphenyl)-6-methoxypyridine-2,5-diamine (CID 43261354) is 2-N-(2-ethoxyphenyl)-6-methoxypyridine-2,5-diamine.
What is the SMILES notation for 2-N-(2-ethoxyphenyl)-6-methoxypyridine-2,5-diamine?
The canonical SMILES for 2-N-(2-ethoxyphenyl)-6-methoxypyridine-2,5-diamine is CCOc1ccccc1Nc1ccc(N)c(OC)n1.
What is the InChIKey of 2-N-(2-ethoxyphenyl)-6-methoxypyridine-2,5-diamine?
The InChIKey is STNBLVPNIMXLQY-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H17N3O2/c1-3-19-12-7-5-4-6-11(12)16-13-9-8-10(15)14(17-13)18-2/h4-9H,3,15H2,1-2H3,(H,16,17).
What are the key properties of 2-N-(2-ethoxyphenyl)-6-methoxypyridine-2,5-diamine?
2-N-(2-ethoxyphenyl)-6-methoxypyridine-2,5-diamine has a molecular weight of 259.31 g/mol, XLogP of 2.81, 5 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 2-N-(2-ethoxyphenyl)-6-methoxypyridine-2,5-diamine is sourced from PubChem (CID 43261354), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).