6-methoxy-2-N-(3-methoxyphenyl)pyridine-2,5-diamine

C13H15N3O2 — CID 43261675

IUPAC6-methoxy-2-N-(3-methoxyphenyl)pyridine-2,5-diamine
SMILESCOc1cccc(Nc2ccc(N)c(OC)n2)c1
InChIInChI=1S/C13H15N3O2/c1-17-10-5-3-4-9(8-10)15-12-7-6-11(14)13(16-12)18-2/h3-8H,14H2,1-2H3,(H,15,16)
InChIKeyBRNSKDLBLZCXLE-UHFFFAOYSA-N
MW245.28 g/mol
LogP2.42
Rot. Bonds4

About 6-methoxy-2-N-(3-methoxyphenyl)pyridine-2,5-diamine

6-methoxy-2-N-(3-methoxyphenyl)pyridine-2,5-diamine (PubChem CID 43261675) has the molecular formula C13H15N3O2 and a molecular weight of 245.28 g/mol. Its IUPAC name is 6-methoxy-2-N-(3-methoxyphenyl)pyridine-2,5-diamine.

Molecular Properties

Compound Name6-methoxy-2-N-(3-methoxyphenyl)pyridine-2,5-diamine
PubChem CID43261675
Molecular FormulaC13H15N3O2
Molecular Weight245.28 g/mol
Exact Mass245.12
IUPAC Name6-methoxy-2-N-(3-methoxyphenyl)pyridine-2,5-diamine
SMILESCOc1cccc(Nc2ccc(N)c(OC)n2)c1
InChIInChI=1S/C13H15N3O2/c1-17-10-5-3-4-9(8-10)15-12-7-6-11(14)13(16-12)18-2/h3-8H,14H2,1-2H3,(H,15,16)
InChIKeyBRNSKDLBLZCXLE-UHFFFAOYSA-N
XLogP2.42
TPSA69.40 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds4
Heavy Atoms18
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500245.28
LogP ≤ 52.42
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

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Frequently Asked Questions

What is the IUPAC name of 6-methoxy-2-N-(3-methoxyphenyl)pyridine-2,5-diamine?
The IUPAC name of 6-methoxy-2-N-(3-methoxyphenyl)pyridine-2,5-diamine (CID 43261675) is 6-methoxy-2-N-(3-methoxyphenyl)pyridine-2,5-diamine.
What is the SMILES notation for 6-methoxy-2-N-(3-methoxyphenyl)pyridine-2,5-diamine?
The canonical SMILES for 6-methoxy-2-N-(3-methoxyphenyl)pyridine-2,5-diamine is COc1cccc(Nc2ccc(N)c(OC)n2)c1.
What is the InChIKey of 6-methoxy-2-N-(3-methoxyphenyl)pyridine-2,5-diamine?
The InChIKey is BRNSKDLBLZCXLE-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H15N3O2/c1-17-10-5-3-4-9(8-10)15-12-7-6-11(14)13(16-12)18-2/h3-8H,14H2,1-2H3,(H,15,16).
What are the key properties of 6-methoxy-2-N-(3-methoxyphenyl)pyridine-2,5-diamine?
6-methoxy-2-N-(3-methoxyphenyl)pyridine-2,5-diamine has a molecular weight of 245.28 g/mol, XLogP of 2.42, 4 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 6-methoxy-2-N-(3-methoxyphenyl)pyridine-2,5-diamine is sourced from PubChem (CID 43261675), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).