2-(1H-indazol-5-yl)imidazo[1,2-a]pyrimidine

C13H9N5 — CID 25167280

IUPAC2-(1H-indazol-5-yl)imidazo[1,2-a]pyrimidine
SMILESc1cnc2nc(-c3ccc4[nH]ncc4c3)cn2c1
InChIInChI=1S/C13H9N5/c1-4-14-13-16-12(8-18(13)5-1)9-2-3-11-10(6-9)7-15-17-11/h1-8H,(H,15,17)
InChIKeyCPGKMMMSMJKHDL-UHFFFAOYSA-N
MW235.25 g/mol
LogP2.27
Rot. Bonds1

About 2-(1H-indazol-5-yl)imidazo[1,2-a]pyrimidine

2-(1H-indazol-5-yl)imidazo[1,2-a]pyrimidine (PubChem CID 25167280) has the molecular formula C13H9N5 and a molecular weight of 235.25 g/mol. Its IUPAC name is 2-(1H-indazol-5-yl)imidazo[1,2-a]pyrimidine.

Molecular Properties

Compound Name2-(1H-indazol-5-yl)imidazo[1,2-a]pyrimidine
PubChem CID25167280
Molecular FormulaC13H9N5
Molecular Weight235.25 g/mol
Exact Mass235.09
IUPAC Name2-(1H-indazol-5-yl)imidazo[1,2-a]pyrimidine
SMILESc1cnc2nc(-c3ccc4[nH]ncc4c3)cn2c1
InChIInChI=1S/C13H9N5/c1-4-14-13-16-12(8-18(13)5-1)9-2-3-11-10(6-9)7-15-17-11/h1-8H,(H,15,17)
InChIKeyCPGKMMMSMJKHDL-UHFFFAOYSA-N
XLogP2.27
TPSA58.87 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds1
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500235.25
LogP ≤ 52.27
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of 2-(1H-indazol-5-yl)imidazo[1,2-a]pyrimidine?
The IUPAC name of 2-(1H-indazol-5-yl)imidazo[1,2-a]pyrimidine (CID 25167280) is 2-(1H-indazol-5-yl)imidazo[1,2-a]pyrimidine.
What is the SMILES notation for 2-(1H-indazol-5-yl)imidazo[1,2-a]pyrimidine?
The canonical SMILES for 2-(1H-indazol-5-yl)imidazo[1,2-a]pyrimidine is c1cnc2nc(-c3ccc4[nH]ncc4c3)cn2c1.
What is the InChIKey of 2-(1H-indazol-5-yl)imidazo[1,2-a]pyrimidine?
The InChIKey is CPGKMMMSMJKHDL-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H9N5/c1-4-14-13-16-12(8-18(13)5-1)9-2-3-11-10(6-9)7-15-17-11/h1-8H,(H,15,17).
What are the key properties of 2-(1H-indazol-5-yl)imidazo[1,2-a]pyrimidine?
2-(1H-indazol-5-yl)imidazo[1,2-a]pyrimidine has a molecular weight of 235.25 g/mol, XLogP of 2.27, 1 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(1H-indazol-5-yl)imidazo[1,2-a]pyrimidine is sourced from PubChem (CID 25167280), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).