7-aminoimidazo[1,2-a]pyrimidine-3,6-diol

C6H6N4O2 — CID 69460196

IUPAC7-aminoimidazo[1,2-a]pyrimidine-3,6-diol
SMILESNc1nc2ncc(O)n2cc1O
InChIInChI=1S/C6H6N4O2/c7-5-3(11)2-10-4(12)1-8-6(10)9-5/h1-2,11-12H,(H2,7,8,9)
InChIKeyXGUTZDBSXNBHDW-UHFFFAOYSA-N
MW166.14 g/mol
LogP-0.28
Rot. Bonds

About 7-aminoimidazo[1,2-a]pyrimidine-3,6-diol

7-aminoimidazo[1,2-a]pyrimidine-3,6-diol (PubChem CID 69460196) has the molecular formula C6H6N4O2 and a molecular weight of 166.14 g/mol. Its IUPAC name is 7-aminoimidazo[1,2-a]pyrimidine-3,6-diol.

Molecular Properties

Compound Name7-aminoimidazo[1,2-a]pyrimidine-3,6-diol
PubChem CID69460196
Molecular FormulaC6H6N4O2
Molecular Weight166.14 g/mol
Exact Mass166.05
IUPAC Name7-aminoimidazo[1,2-a]pyrimidine-3,6-diol
SMILESNc1nc2ncc(O)n2cc1O
InChIInChI=1S/C6H6N4O2/c7-5-3(11)2-10-4(12)1-8-6(10)9-5/h1-2,11-12H,(H2,7,8,9)
InChIKeyXGUTZDBSXNBHDW-UHFFFAOYSA-N
XLogP-0.28
TPSA96.67 Ų
H-Bond Donors3
H-Bond Acceptors6
Rotatable Bonds
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500166.14
LogP ≤ 5-0.28
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 106

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Related Compounds

7-Fluoroimidazo[1,2-a]pyrimidin-3-ol
CID 55265978
5-Fluoroimidazo[1,2-a]pyrimidin-3-ol
CID 55266291
7-Fluoroimidazo[1,2-a]pyrimidin-2-ol
CID 55266442
5-Fluoroimidazo[1,2-a]pyrimidin-2-ol
CID 55266755
Imidazo[1,2-a]pyrimidin-2-ol
CID 55266756
Triazolo[1,5-a]pyrimidin-6-ol
CID 57096157
2-Methylimidazo[1,2-a]pyrimidin-6-ol
CID 68265616
Imidazo[1,2-a]pyrimidine-3,6-diol
CID 69460413
Imidazo[1,5-a]pyrimidin-3-ol
CID 69463181
6-Methoxyimidazo[1,2-a]pyrimidine
CID 83770968
Imidazo[1,2-a]pyrimidin-6-yl hydrogen carbonate
CID 124136227
5-Aminoimidazo[1,5-a]pyrazin-1-ol
CID 136344986

Frequently Asked Questions

What is the IUPAC name of 7-aminoimidazo[1,2-a]pyrimidine-3,6-diol?
The IUPAC name of 7-aminoimidazo[1,2-a]pyrimidine-3,6-diol (CID 69460196) is 7-aminoimidazo[1,2-a]pyrimidine-3,6-diol.
What is the SMILES notation for 7-aminoimidazo[1,2-a]pyrimidine-3,6-diol?
The canonical SMILES for 7-aminoimidazo[1,2-a]pyrimidine-3,6-diol is Nc1nc2ncc(O)n2cc1O.
What is the InChIKey of 7-aminoimidazo[1,2-a]pyrimidine-3,6-diol?
The InChIKey is XGUTZDBSXNBHDW-UHFFFAOYSA-N. The full InChI is InChI=1S/C6H6N4O2/c7-5-3(11)2-10-4(12)1-8-6(10)9-5/h1-2,11-12H,(H2,7,8,9).
What are the key properties of 7-aminoimidazo[1,2-a]pyrimidine-3,6-diol?
7-aminoimidazo[1,2-a]pyrimidine-3,6-diol has a molecular weight of 166.14 g/mol, XLogP of -0.28, 0 rotatable bonds, 3 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 7-aminoimidazo[1,2-a]pyrimidine-3,6-diol is sourced from PubChem (CID 69460196), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).