5,6-dimethyl-[1,2,5]oxadiazolo[3,4-b]pyridin-7-amine;ethane

C9H14N4O — CID 142280410

IUPAC5,6-dimethyl-[1,2,5]oxadiazolo[3,4-b]pyridin-7-amine;ethane
SMILESCC.Cc1nc2nonc2c(N)c1C
InChIInChI=1S/C7H8N4O.C2H6/c1-3-4(2)9-7-6(5(3)8)10-12-11-7;1-2/h8H2,1-2H3;1-2H3
InChIKeyUFZQKVKANQFDNO-UHFFFAOYSA-N
MW194.24 g/mol
LogP1.84
Rot. Bonds

About 5,6-dimethyl-[1,2,5]oxadiazolo[3,4-b]pyridin-7-amine;ethane

5,6-dimethyl-[1,2,5]oxadiazolo[3,4-b]pyridin-7-amine;ethane (PubChem CID 142280410) has the molecular formula C9H14N4O and a molecular weight of 194.24 g/mol. Its IUPAC name is 5,6-dimethyl-[1,2,5]oxadiazolo[3,4-b]pyridin-7-amine;ethane.

Molecular Properties

Compound Name5,6-dimethyl-[1,2,5]oxadiazolo[3,4-b]pyridin-7-amine;ethane
PubChem CID142280410
Molecular FormulaC9H14N4O
Molecular Weight194.24 g/mol
Exact Mass194.12
IUPAC Name5,6-dimethyl-[1,2,5]oxadiazolo[3,4-b]pyridin-7-amine;ethane
SMILESCC.Cc1nc2nonc2c(N)c1C
InChIInChI=1S/C7H8N4O.C2H6/c1-3-4(2)9-7-6(5(3)8)10-12-11-7;1-2/h8H2,1-2H3;1-2H3
InChIKeyUFZQKVKANQFDNO-UHFFFAOYSA-N
XLogP1.84
TPSA77.83 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500194.24
LogP ≤ 51.84
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Frequently Asked Questions

What is the IUPAC name of 5,6-dimethyl-[1,2,5]oxadiazolo[3,4-b]pyridin-7-amine;ethane?
The IUPAC name of 5,6-dimethyl-[1,2,5]oxadiazolo[3,4-b]pyridin-7-amine;ethane (CID 142280410) is 5,6-dimethyl-[1,2,5]oxadiazolo[3,4-b]pyridin-7-amine;ethane.
What is the SMILES notation for 5,6-dimethyl-[1,2,5]oxadiazolo[3,4-b]pyridin-7-amine;ethane?
The canonical SMILES for 5,6-dimethyl-[1,2,5]oxadiazolo[3,4-b]pyridin-7-amine;ethane is CC.Cc1nc2nonc2c(N)c1C.
What is the InChIKey of 5,6-dimethyl-[1,2,5]oxadiazolo[3,4-b]pyridin-7-amine;ethane?
The InChIKey is UFZQKVKANQFDNO-UHFFFAOYSA-N. The full InChI is InChI=1S/C7H8N4O.C2H6/c1-3-4(2)9-7-6(5(3)8)10-12-11-7;1-2/h8H2,1-2H3;1-2H3.
What are the key properties of 5,6-dimethyl-[1,2,5]oxadiazolo[3,4-b]pyridin-7-amine;ethane?
5,6-dimethyl-[1,2,5]oxadiazolo[3,4-b]pyridin-7-amine;ethane has a molecular weight of 194.24 g/mol, XLogP of 1.84, 0 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 5,6-dimethyl-[1,2,5]oxadiazolo[3,4-b]pyridin-7-amine;ethane is sourced from PubChem (CID 142280410), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).