4-(7-anilino-1-ethylimidazo[4,5-c]pyridin-2-yl)-1,2,5-oxadiazol-3-amine

C16H15N7O — CID 59681825

IUPAC4-(7-anilino-1-ethylimidazo[4,5-c]pyridin-2-yl)-1,2,5-oxadiazol-3-amine
SMILESCCn1c(-c2nonc2N)nc2cncc(Nc3ccccc3)c21
InChIInChI=1S/C16H15N7O/c1-2-23-14-11(19-10-6-4-3-5-7-10)8-18-9-12(14)20-16(23)13-15(17)22-24-21-13/h3-9,19H,2H2,1H3,(H2,17,22)
InChIKeyCPJUUPQQCRHMAE-UHFFFAOYSA-N
MW321.34 g/mol
LogP2.83
Rot. Bonds4

About 4-(7-anilino-1-ethylimidazo[4,5-c]pyridin-2-yl)-1,2,5-oxadiazol-3-amine

4-(7-anilino-1-ethylimidazo[4,5-c]pyridin-2-yl)-1,2,5-oxadiazol-3-amine (PubChem CID 59681825) has the molecular formula C16H15N7O and a molecular weight of 321.34 g/mol. Its IUPAC name is 4-(7-anilino-1-ethylimidazo[4,5-c]pyridin-2-yl)-1,2,5-oxadiazol-3-amine.

Molecular Properties

Compound Name4-(7-anilino-1-ethylimidazo[4,5-c]pyridin-2-yl)-1,2,5-oxadiazol-3-amine
PubChem CID59681825
Molecular FormulaC16H15N7O
Molecular Weight321.34 g/mol
Exact Mass321.13
IUPAC Name4-(7-anilino-1-ethylimidazo[4,5-c]pyridin-2-yl)-1,2,5-oxadiazol-3-amine
SMILESCCn1c(-c2nonc2N)nc2cncc(Nc3ccccc3)c21
InChIInChI=1S/C16H15N7O/c1-2-23-14-11(19-10-6-4-3-5-7-10)8-18-9-12(14)20-16(23)13-15(17)22-24-21-13/h3-9,19H,2H2,1H3,(H2,17,22)
InChIKeyCPJUUPQQCRHMAE-UHFFFAOYSA-N
XLogP2.83
TPSA107.68 Ų
H-Bond Donors2
H-Bond Acceptors8
Rotatable Bonds4
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500321.34
LogP ≤ 52.83
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 108

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Frequently Asked Questions

What is the IUPAC name of 4-(7-anilino-1-ethylimidazo[4,5-c]pyridin-2-yl)-1,2,5-oxadiazol-3-amine?
The IUPAC name of 4-(7-anilino-1-ethylimidazo[4,5-c]pyridin-2-yl)-1,2,5-oxadiazol-3-amine (CID 59681825) is 4-(7-anilino-1-ethylimidazo[4,5-c]pyridin-2-yl)-1,2,5-oxadiazol-3-amine.
What is the SMILES notation for 4-(7-anilino-1-ethylimidazo[4,5-c]pyridin-2-yl)-1,2,5-oxadiazol-3-amine?
The canonical SMILES for 4-(7-anilino-1-ethylimidazo[4,5-c]pyridin-2-yl)-1,2,5-oxadiazol-3-amine is CCn1c(-c2nonc2N)nc2cncc(Nc3ccccc3)c21.
What is the InChIKey of 4-(7-anilino-1-ethylimidazo[4,5-c]pyridin-2-yl)-1,2,5-oxadiazol-3-amine?
The InChIKey is CPJUUPQQCRHMAE-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H15N7O/c1-2-23-14-11(19-10-6-4-3-5-7-10)8-18-9-12(14)20-16(23)13-15(17)22-24-21-13/h3-9,19H,2H2,1H3,(H2,17,22).
What are the key properties of 4-(7-anilino-1-ethylimidazo[4,5-c]pyridin-2-yl)-1,2,5-oxadiazol-3-amine?
4-(7-anilino-1-ethylimidazo[4,5-c]pyridin-2-yl)-1,2,5-oxadiazol-3-amine has a molecular weight of 321.34 g/mol, XLogP of 2.83, 4 rotatable bonds, 2 hydrogen bond donors, and 8 hydrogen bond acceptors.
Where does this data come from?
All data for 4-(7-anilino-1-ethylimidazo[4,5-c]pyridin-2-yl)-1,2,5-oxadiazol-3-amine is sourced from PubChem (CID 59681825), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).