4-furo[3,2-b]pyridin-5-ylpyridine-2,6-diamine

C12H10N4O — CID 166630039

IUPAC4-furo[3,2-b]pyridin-5-ylpyridine-2,6-diamine
SMILESNc1cc(-c2ccc3occc3n2)cc(N)n1
InChIInChI=1S/C12H10N4O/c13-11-5-7(6-12(14)16-11)8-1-2-10-9(15-8)3-4-17-10/h1-6H,(H4,13,14,16)
InChIKeyFPPAJLKYIORDOV-UHFFFAOYSA-N
MW226.24 g/mol
LogP2.05
Rot. Bonds1

About 4-furo[3,2-b]pyridin-5-ylpyridine-2,6-diamine

4-furo[3,2-b]pyridin-5-ylpyridine-2,6-diamine (PubChem CID 166630039) has the molecular formula C12H10N4O and a molecular weight of 226.24 g/mol. Its IUPAC name is 4-furo[3,2-b]pyridin-5-ylpyridine-2,6-diamine.

Molecular Properties

Compound Name4-furo[3,2-b]pyridin-5-ylpyridine-2,6-diamine
PubChem CID166630039
Molecular FormulaC12H10N4O
Molecular Weight226.24 g/mol
Exact Mass226.09
IUPAC Name4-furo[3,2-b]pyridin-5-ylpyridine-2,6-diamine
SMILESNc1cc(-c2ccc3occc3n2)cc(N)n1
InChIInChI=1S/C12H10N4O/c13-11-5-7(6-12(14)16-11)8-1-2-10-9(15-8)3-4-17-10/h1-6H,(H4,13,14,16)
InChIKeyFPPAJLKYIORDOV-UHFFFAOYSA-N
XLogP2.05
TPSA90.96 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds1
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500226.24
LogP ≤ 52.05
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

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Frequently Asked Questions

What is the IUPAC name of 4-furo[3,2-b]pyridin-5-ylpyridine-2,6-diamine?
The IUPAC name of 4-furo[3,2-b]pyridin-5-ylpyridine-2,6-diamine (CID 166630039) is 4-furo[3,2-b]pyridin-5-ylpyridine-2,6-diamine.
What is the SMILES notation for 4-furo[3,2-b]pyridin-5-ylpyridine-2,6-diamine?
The canonical SMILES for 4-furo[3,2-b]pyridin-5-ylpyridine-2,6-diamine is Nc1cc(-c2ccc3occc3n2)cc(N)n1.
What is the InChIKey of 4-furo[3,2-b]pyridin-5-ylpyridine-2,6-diamine?
The InChIKey is FPPAJLKYIORDOV-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H10N4O/c13-11-5-7(6-12(14)16-11)8-1-2-10-9(15-8)3-4-17-10/h1-6H,(H4,13,14,16).
What are the key properties of 4-furo[3,2-b]pyridin-5-ylpyridine-2,6-diamine?
4-furo[3,2-b]pyridin-5-ylpyridine-2,6-diamine has a molecular weight of 226.24 g/mol, XLogP of 2.05, 1 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 4-furo[3,2-b]pyridin-5-ylpyridine-2,6-diamine is sourced from PubChem (CID 166630039), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).