6-hydroxy-5,7-dihydropyrrolo[3,4-d]pyrimidine

C6H7N3O — CID 175171276

IUPAC6-hydroxy-5,7-dihydropyrrolo[3,4-d]pyrimidine
SMILESON1Cc2cncnc2C1
InChIInChI=1S/C6H7N3O/c10-9-2-5-1-7-4-8-6(5)3-9/h1,4,10H,2-3H2
InChIKeyMYOJJICYPHXPOH-UHFFFAOYSA-N
MW137.14 g/mol
LogP0.18
Rot. Bonds

About 6-hydroxy-5,7-dihydropyrrolo[3,4-d]pyrimidine

6-hydroxy-5,7-dihydropyrrolo[3,4-d]pyrimidine (PubChem CID 175171276) has the molecular formula C6H7N3O and a molecular weight of 137.14 g/mol. Its IUPAC name is 6-hydroxy-5,7-dihydropyrrolo[3,4-d]pyrimidine.

Molecular Properties

Compound Name6-hydroxy-5,7-dihydropyrrolo[3,4-d]pyrimidine
PubChem CID175171276
Molecular FormulaC6H7N3O
Molecular Weight137.14 g/mol
Exact Mass137.06
IUPAC Name6-hydroxy-5,7-dihydropyrrolo[3,4-d]pyrimidine
SMILESON1Cc2cncnc2C1
InChIInChI=1S/C6H7N3O/c10-9-2-5-1-7-4-8-6(5)3-9/h1,4,10H,2-3H2
InChIKeyMYOJJICYPHXPOH-UHFFFAOYSA-N
XLogP0.18
TPSA49.25 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds
Heavy Atoms10
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500137.14
LogP ≤ 50.18
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of 6-hydroxy-5,7-dihydropyrrolo[3,4-d]pyrimidine?
The IUPAC name of 6-hydroxy-5,7-dihydropyrrolo[3,4-d]pyrimidine (CID 175171276) is 6-hydroxy-5,7-dihydropyrrolo[3,4-d]pyrimidine.
What is the SMILES notation for 6-hydroxy-5,7-dihydropyrrolo[3,4-d]pyrimidine?
The canonical SMILES for 6-hydroxy-5,7-dihydropyrrolo[3,4-d]pyrimidine is ON1Cc2cncnc2C1.
What is the InChIKey of 6-hydroxy-5,7-dihydropyrrolo[3,4-d]pyrimidine?
The InChIKey is MYOJJICYPHXPOH-UHFFFAOYSA-N. The full InChI is InChI=1S/C6H7N3O/c10-9-2-5-1-7-4-8-6(5)3-9/h1,4,10H,2-3H2.
What are the key properties of 6-hydroxy-5,7-dihydropyrrolo[3,4-d]pyrimidine?
6-hydroxy-5,7-dihydropyrrolo[3,4-d]pyrimidine has a molecular weight of 137.14 g/mol, XLogP of 0.18, 0 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 6-hydroxy-5,7-dihydropyrrolo[3,4-d]pyrimidine is sourced from PubChem (CID 175171276), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).