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

C8H10N4O — CID 135438441

IUPAC2-amino-6-ethyl-3,7-dihydropyrrolo[2,3-d]pyrimidin-4-one
SMILESCCc1cc2c(=O)[nH]c(N)nc2[nH]1
InChIInChI=1S/C8H10N4O/c1-2-4-3-5-6(10-4)11-8(9)12-7(5)13/h3H,2H2,1H3,(H4,9,10,11,12,13)
InChIKeyGUSKBXCBYRSLCQ-UHFFFAOYSA-N
MW178.19 g/mol
LogP0.40
Rot. Bonds1

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

2-amino-6-ethyl-3,7-dihydropyrrolo[2,3-d]pyrimidin-4-one (PubChem CID 135438441) has the molecular formula C8H10N4O and a molecular weight of 178.19 g/mol. Its IUPAC name is 2-amino-6-ethyl-3,7-dihydropyrrolo[2,3-d]pyrimidin-4-one.

Molecular Properties

Compound Name2-amino-6-ethyl-3,7-dihydropyrrolo[2,3-d]pyrimidin-4-one
PubChem CID135438441
Molecular FormulaC8H10N4O
Molecular Weight178.19 g/mol
Exact Mass178.09
IUPAC Name2-amino-6-ethyl-3,7-dihydropyrrolo[2,3-d]pyrimidin-4-one
SMILESCCc1cc2c(=O)[nH]c(N)nc2[nH]1
InChIInChI=1S/C8H10N4O/c1-2-4-3-5-6(10-4)11-8(9)12-7(5)13/h3H,2H2,1H3,(H4,9,10,11,12,13)
InChIKeyGUSKBXCBYRSLCQ-UHFFFAOYSA-N
XLogP0.40
TPSA87.56 Ų
H-Bond Donors3
H-Bond Acceptors3
Rotatable Bonds1
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500178.19
LogP ≤ 50.40
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 103

Analyze 2-amino-6-ethyl-3,7-dihydropyrrolo[2,3-d]pyrimidin-4-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 2-amino-6-ethyl-3,7-dihydropyrrolo[2,3-d]pyrimidin-4-one?
The IUPAC name of 2-amino-6-ethyl-3,7-dihydropyrrolo[2,3-d]pyrimidin-4-one (CID 135438441) is 2-amino-6-ethyl-3,7-dihydropyrrolo[2,3-d]pyrimidin-4-one.
What is the SMILES notation for 2-amino-6-ethyl-3,7-dihydropyrrolo[2,3-d]pyrimidin-4-one?
The canonical SMILES for 2-amino-6-ethyl-3,7-dihydropyrrolo[2,3-d]pyrimidin-4-one is CCc1cc2c(=O)[nH]c(N)nc2[nH]1.
What is the InChIKey of 2-amino-6-ethyl-3,7-dihydropyrrolo[2,3-d]pyrimidin-4-one?
The InChIKey is GUSKBXCBYRSLCQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H10N4O/c1-2-4-3-5-6(10-4)11-8(9)12-7(5)13/h3H,2H2,1H3,(H4,9,10,11,12,13).
What are the key properties of 2-amino-6-ethyl-3,7-dihydropyrrolo[2,3-d]pyrimidin-4-one?
2-amino-6-ethyl-3,7-dihydropyrrolo[2,3-d]pyrimidin-4-one has a molecular weight of 178.19 g/mol, XLogP of 0.40, 1 rotatable bonds, 3 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-amino-6-ethyl-3,7-dihydropyrrolo[2,3-d]pyrimidin-4-one is sourced from PubChem (CID 135438441), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).