4-amino-5-methyl-5,7-dihydropyrrolo[2,3-d]pyrimidin-6-one

C7H8N4O — CID 84651793

IUPAC4-amino-5-methyl-5,7-dihydropyrrolo[2,3-d]pyrimidin-6-one
SMILESCC1C(=O)Nc2ncnc(N)c21
InChIInChI=1S/C7H8N4O/c1-3-4-5(8)9-2-10-6(4)11-7(3)12/h2-3H,1H3,(H3,8,9,10,11,12)
InChIKeyCBYDVLCKAJTXRM-UHFFFAOYSA-N
MW164.17 g/mol
LogP0.11
Rot. Bonds

About 4-amino-5-methyl-5,7-dihydropyrrolo[2,3-d]pyrimidin-6-one

4-amino-5-methyl-5,7-dihydropyrrolo[2,3-d]pyrimidin-6-one (PubChem CID 84651793) has the molecular formula C7H8N4O and a molecular weight of 164.17 g/mol. Its IUPAC name is 4-amino-5-methyl-5,7-dihydropyrrolo[2,3-d]pyrimidin-6-one.

Molecular Properties

Compound Name4-amino-5-methyl-5,7-dihydropyrrolo[2,3-d]pyrimidin-6-one
PubChem CID84651793
Molecular FormulaC7H8N4O
Molecular Weight164.17 g/mol
Exact Mass164.07
IUPAC Name4-amino-5-methyl-5,7-dihydropyrrolo[2,3-d]pyrimidin-6-one
SMILESCC1C(=O)Nc2ncnc(N)c21
InChIInChI=1S/C7H8N4O/c1-3-4-5(8)9-2-10-6(4)11-7(3)12/h2-3H,1H3,(H3,8,9,10,11,12)
InChIKeyCBYDVLCKAJTXRM-UHFFFAOYSA-N
XLogP0.11
TPSA80.90 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500164.17
LogP ≤ 50.11
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

Analyze 4-amino-5-methyl-5,7-dihydropyrrolo[2,3-d]pyrimidin-6-one with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Frequently Asked Questions

What is the IUPAC name of 4-amino-5-methyl-5,7-dihydropyrrolo[2,3-d]pyrimidin-6-one?
The IUPAC name of 4-amino-5-methyl-5,7-dihydropyrrolo[2,3-d]pyrimidin-6-one (CID 84651793) is 4-amino-5-methyl-5,7-dihydropyrrolo[2,3-d]pyrimidin-6-one.
What is the SMILES notation for 4-amino-5-methyl-5,7-dihydropyrrolo[2,3-d]pyrimidin-6-one?
The canonical SMILES for 4-amino-5-methyl-5,7-dihydropyrrolo[2,3-d]pyrimidin-6-one is CC1C(=O)Nc2ncnc(N)c21.
What is the InChIKey of 4-amino-5-methyl-5,7-dihydropyrrolo[2,3-d]pyrimidin-6-one?
The InChIKey is CBYDVLCKAJTXRM-UHFFFAOYSA-N. The full InChI is InChI=1S/C7H8N4O/c1-3-4-5(8)9-2-10-6(4)11-7(3)12/h2-3H,1H3,(H3,8,9,10,11,12).
What are the key properties of 4-amino-5-methyl-5,7-dihydropyrrolo[2,3-d]pyrimidin-6-one?
4-amino-5-methyl-5,7-dihydropyrrolo[2,3-d]pyrimidin-6-one has a molecular weight of 164.17 g/mol, XLogP of 0.11, 0 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 4-amino-5-methyl-5,7-dihydropyrrolo[2,3-d]pyrimidin-6-one is sourced from PubChem (CID 84651793), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).