6-(1H-indazol-6-yl)pyrimidin-4-amine

C11H9N5 — CID 127263726

IUPAC6-(1H-indazol-6-yl)pyrimidin-4-amine
SMILESNc1cc(-c2ccc3cn[nH]c3c2)ncn1
InChIInChI=1S/C11H9N5/c12-11-4-9(13-6-14-11)7-1-2-8-5-15-16-10(8)3-7/h1-6H,(H,15,16)(H2,12,13,14)
InChIKeyMBERPCWKQWTGJS-UHFFFAOYSA-N
MW211.23 g/mol
LogP1.60
Rot. Bonds1

About 6-(1H-indazol-6-yl)pyrimidin-4-amine

6-(1H-indazol-6-yl)pyrimidin-4-amine (PubChem CID 127263726) has the molecular formula C11H9N5 and a molecular weight of 211.23 g/mol. Its IUPAC name is 6-(1H-indazol-6-yl)pyrimidin-4-amine.

Molecular Properties

Compound Name6-(1H-indazol-6-yl)pyrimidin-4-amine
PubChem CID127263726
Molecular FormulaC11H9N5
Molecular Weight211.23 g/mol
Exact Mass211.09
IUPAC Name6-(1H-indazol-6-yl)pyrimidin-4-amine
SMILESNc1cc(-c2ccc3cn[nH]c3c2)ncn1
InChIInChI=1S/C11H9N5/c12-11-4-9(13-6-14-11)7-1-2-8-5-15-16-10(8)3-7/h1-6H,(H,15,16)(H2,12,13,14)
InChIKeyMBERPCWKQWTGJS-UHFFFAOYSA-N
XLogP1.60
TPSA80.48 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds1
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500211.23
LogP ≤ 51.60
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of 6-(1H-indazol-6-yl)pyrimidin-4-amine?
The IUPAC name of 6-(1H-indazol-6-yl)pyrimidin-4-amine (CID 127263726) is 6-(1H-indazol-6-yl)pyrimidin-4-amine.
What is the SMILES notation for 6-(1H-indazol-6-yl)pyrimidin-4-amine?
The canonical SMILES for 6-(1H-indazol-6-yl)pyrimidin-4-amine is Nc1cc(-c2ccc3cn[nH]c3c2)ncn1.
What is the InChIKey of 6-(1H-indazol-6-yl)pyrimidin-4-amine?
The InChIKey is MBERPCWKQWTGJS-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H9N5/c12-11-4-9(13-6-14-11)7-1-2-8-5-15-16-10(8)3-7/h1-6H,(H,15,16)(H2,12,13,14).
What are the key properties of 6-(1H-indazol-6-yl)pyrimidin-4-amine?
6-(1H-indazol-6-yl)pyrimidin-4-amine has a molecular weight of 211.23 g/mol, XLogP of 1.60, 1 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 6-(1H-indazol-6-yl)pyrimidin-4-amine is sourced from PubChem (CID 127263726), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).