6-(2-aminopyrimidin-4-yl)-1H-indazol-3-amine

C11H10N6 — CID 46215814

IUPAC6-(2-aminopyrimidin-4-yl)-1H-indazol-3-amine
SMILESNc1nccc(-c2ccc3c(N)n[nH]c3c2)n1
InChIInChI=1S/C11H10N6/c12-10-7-2-1-6(5-9(7)16-17-10)8-3-4-14-11(13)15-8/h1-5H,(H3,12,16,17)(H2,13,14,15)
InChIKeyQVWIVWPIJUYRRF-UHFFFAOYSA-N
MW226.24 g/mol
LogP1.18
Rot. Bonds1

About 6-(2-aminopyrimidin-4-yl)-1H-indazol-3-amine

6-(2-aminopyrimidin-4-yl)-1H-indazol-3-amine (PubChem CID 46215814) has the molecular formula C11H10N6 and a molecular weight of 226.24 g/mol. Its IUPAC name is 6-(2-aminopyrimidin-4-yl)-1H-indazol-3-amine.

Molecular Properties

Compound Name6-(2-aminopyrimidin-4-yl)-1H-indazol-3-amine
PubChem CID46215814
Molecular FormulaC11H10N6
Molecular Weight226.24 g/mol
Exact Mass226.10
IUPAC Name6-(2-aminopyrimidin-4-yl)-1H-indazol-3-amine
SMILESNc1nccc(-c2ccc3c(N)n[nH]c3c2)n1
InChIInChI=1S/C11H10N6/c12-10-7-2-1-6(5-9(7)16-17-10)8-3-4-14-11(13)15-8/h1-5H,(H3,12,16,17)(H2,13,14,15)
InChIKeyQVWIVWPIJUYRRF-UHFFFAOYSA-N
XLogP1.18
TPSA106.50 Ų
H-Bond Donors3
H-Bond Acceptors5
Rotatable Bonds1
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500226.24
LogP ≤ 51.18
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 105

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Frequently Asked Questions

What is the IUPAC name of 6-(2-aminopyrimidin-4-yl)-1H-indazol-3-amine?
The IUPAC name of 6-(2-aminopyrimidin-4-yl)-1H-indazol-3-amine (CID 46215814) is 6-(2-aminopyrimidin-4-yl)-1H-indazol-3-amine.
What is the SMILES notation for 6-(2-aminopyrimidin-4-yl)-1H-indazol-3-amine?
The canonical SMILES for 6-(2-aminopyrimidin-4-yl)-1H-indazol-3-amine is Nc1nccc(-c2ccc3c(N)n[nH]c3c2)n1.
What is the InChIKey of 6-(2-aminopyrimidin-4-yl)-1H-indazol-3-amine?
The InChIKey is QVWIVWPIJUYRRF-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H10N6/c12-10-7-2-1-6(5-9(7)16-17-10)8-3-4-14-11(13)15-8/h1-5H,(H3,12,16,17)(H2,13,14,15).
What are the key properties of 6-(2-aminopyrimidin-4-yl)-1H-indazol-3-amine?
6-(2-aminopyrimidin-4-yl)-1H-indazol-3-amine has a molecular weight of 226.24 g/mol, XLogP of 1.18, 1 rotatable bonds, 3 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 6-(2-aminopyrimidin-4-yl)-1H-indazol-3-amine is sourced from PubChem (CID 46215814), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).