5-amino-6-(2-hydroxyethylamino)-1H-pyrimidine-2,4-dione

C6H10N4O3 — CID 14198223

IUPAC5-amino-6-(2-hydroxyethylamino)-1H-pyrimidine-2,4-dione
SMILESNc1c(NCCO)[nH]c(=O)[nH]c1=O
InChIInChI=1S/C6H10N4O3/c7-3-4(8-1-2-11)9-6(13)10-5(3)12/h11H,1-2,7H2,(H3,8,9,10,12,13)
InChIKeyDQJBMEXYSHRWHP-UHFFFAOYSA-N
MW186.17 g/mol
LogP-1.95
Rot. Bonds3

About 5-amino-6-(2-hydroxyethylamino)-1H-pyrimidine-2,4-dione

5-amino-6-(2-hydroxyethylamino)-1H-pyrimidine-2,4-dione (PubChem CID 14198223) has the molecular formula C6H10N4O3 and a molecular weight of 186.17 g/mol. Its IUPAC name is 5-amino-6-(2-hydroxyethylamino)-1H-pyrimidine-2,4-dione.

Molecular Properties

Compound Name5-amino-6-(2-hydroxyethylamino)-1H-pyrimidine-2,4-dione
PubChem CID14198223
Molecular FormulaC6H10N4O3
Molecular Weight186.17 g/mol
Exact Mass186.08
IUPAC Name5-amino-6-(2-hydroxyethylamino)-1H-pyrimidine-2,4-dione
SMILESNc1c(NCCO)[nH]c(=O)[nH]c1=O
InChIInChI=1S/C6H10N4O3/c7-3-4(8-1-2-11)9-6(13)10-5(3)12/h11H,1-2,7H2,(H3,8,9,10,12,13)
InChIKeyDQJBMEXYSHRWHP-UHFFFAOYSA-N
XLogP-1.95
TPSA124.00 Ų
H-Bond Donors5
H-Bond Acceptors5
Rotatable Bonds3
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500186.17
LogP ≤ 5-1.95
H-Bond Donors ≤ 55
H-Bond Acceptors ≤ 105

Analyze 5-amino-6-(2-hydroxyethylamino)-1H-pyrimidine-2,4-dione 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 5-amino-6-(2-hydroxyethylamino)-1H-pyrimidine-2,4-dione?
The IUPAC name of 5-amino-6-(2-hydroxyethylamino)-1H-pyrimidine-2,4-dione (CID 14198223) is 5-amino-6-(2-hydroxyethylamino)-1H-pyrimidine-2,4-dione.
What is the SMILES notation for 5-amino-6-(2-hydroxyethylamino)-1H-pyrimidine-2,4-dione?
The canonical SMILES for 5-amino-6-(2-hydroxyethylamino)-1H-pyrimidine-2,4-dione is Nc1c(NCCO)[nH]c(=O)[nH]c1=O.
What is the InChIKey of 5-amino-6-(2-hydroxyethylamino)-1H-pyrimidine-2,4-dione?
The InChIKey is DQJBMEXYSHRWHP-UHFFFAOYSA-N. The full InChI is InChI=1S/C6H10N4O3/c7-3-4(8-1-2-11)9-6(13)10-5(3)12/h11H,1-2,7H2,(H3,8,9,10,12,13).
What are the key properties of 5-amino-6-(2-hydroxyethylamino)-1H-pyrimidine-2,4-dione?
5-amino-6-(2-hydroxyethylamino)-1H-pyrimidine-2,4-dione has a molecular weight of 186.17 g/mol, XLogP of -1.95, 3 rotatable bonds, 5 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 5-amino-6-(2-hydroxyethylamino)-1H-pyrimidine-2,4-dione is sourced from PubChem (CID 14198223), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).