5-(3-amino-1H-indazol-5-yl)-N-ethyl-1,3,4-oxadiazol-2-amine

C11H12N6O — CID 25108868

IUPAC5-(3-amino-1H-indazol-5-yl)-N-ethyl-1,3,4-oxadiazol-2-amine
SMILESCCNc1nnc(-c2ccc3[nH]nc(N)c3c2)o1
InChIInChI=1S/C11H12N6O/c1-2-13-11-17-16-10(18-11)6-3-4-8-7(5-6)9(12)15-14-8/h3-5H,2H2,1H3,(H,13,17)(H3,12,14,15)
InChIKeyGBUQCFHACYDHNL-UHFFFAOYSA-N
MW244.26 g/mol
LogP1.63
Rot. Bonds3

About 5-(3-amino-1H-indazol-5-yl)-N-ethyl-1,3,4-oxadiazol-2-amine

5-(3-amino-1H-indazol-5-yl)-N-ethyl-1,3,4-oxadiazol-2-amine (PubChem CID 25108868) has the molecular formula C11H12N6O and a molecular weight of 244.26 g/mol. Its IUPAC name is 5-(3-amino-1H-indazol-5-yl)-N-ethyl-1,3,4-oxadiazol-2-amine.

Molecular Properties

Compound Name5-(3-amino-1H-indazol-5-yl)-N-ethyl-1,3,4-oxadiazol-2-amine
PubChem CID25108868
Molecular FormulaC11H12N6O
Molecular Weight244.26 g/mol
Exact Mass244.11
IUPAC Name5-(3-amino-1H-indazol-5-yl)-N-ethyl-1,3,4-oxadiazol-2-amine
SMILESCCNc1nnc(-c2ccc3[nH]nc(N)c3c2)o1
InChIInChI=1S/C11H12N6O/c1-2-13-11-17-16-10(18-11)6-3-4-8-7(5-6)9(12)15-14-8/h3-5H,2H2,1H3,(H,13,17)(H3,12,14,15)
InChIKeyGBUQCFHACYDHNL-UHFFFAOYSA-N
XLogP1.63
TPSA105.65 Ų
H-Bond Donors3
H-Bond Acceptors6
Rotatable Bonds3
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500244.26
LogP ≤ 51.63
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 106

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Frequently Asked Questions

What is the IUPAC name of 5-(3-amino-1H-indazol-5-yl)-N-ethyl-1,3,4-oxadiazol-2-amine?
The IUPAC name of 5-(3-amino-1H-indazol-5-yl)-N-ethyl-1,3,4-oxadiazol-2-amine (CID 25108868) is 5-(3-amino-1H-indazol-5-yl)-N-ethyl-1,3,4-oxadiazol-2-amine.
What is the SMILES notation for 5-(3-amino-1H-indazol-5-yl)-N-ethyl-1,3,4-oxadiazol-2-amine?
The canonical SMILES for 5-(3-amino-1H-indazol-5-yl)-N-ethyl-1,3,4-oxadiazol-2-amine is CCNc1nnc(-c2ccc3[nH]nc(N)c3c2)o1.
What is the InChIKey of 5-(3-amino-1H-indazol-5-yl)-N-ethyl-1,3,4-oxadiazol-2-amine?
The InChIKey is GBUQCFHACYDHNL-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H12N6O/c1-2-13-11-17-16-10(18-11)6-3-4-8-7(5-6)9(12)15-14-8/h3-5H,2H2,1H3,(H,13,17)(H3,12,14,15).
What are the key properties of 5-(3-amino-1H-indazol-5-yl)-N-ethyl-1,3,4-oxadiazol-2-amine?
5-(3-amino-1H-indazol-5-yl)-N-ethyl-1,3,4-oxadiazol-2-amine has a molecular weight of 244.26 g/mol, XLogP of 1.63, 3 rotatable bonds, 3 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 5-(3-amino-1H-indazol-5-yl)-N-ethyl-1,3,4-oxadiazol-2-amine is sourced from PubChem (CID 25108868), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).