6-amino-3-[(1R)-2,3-dihydroxy-1-(2-hydroxyethoxy)propyl]-1H-1,3,5-triazine-2,4-dione

C8H14N4O6 — CID 70927151

IUPAC6-amino-3-[(1R)-2,3-dihydroxy-1-(2-hydroxyethoxy)propyl]-1H-1,3,5-triazine-2,4-dione
SMILESNc1nc(=O)n([C@H](OCCO)C(O)CO)c(=O)[nH]1
InChIInChI=1S/C8H14N4O6/c9-6-10-7(16)12(8(17)11-6)5(4(15)3-14)18-2-1-13/h4-5,13-15H,1-3H2,(H3,9,10,11,16,17)/t4?,5-/m1/s1
InChIKeySNYSKUMEKAJWSO-BRJRFNKRSA-N
MW262.22 g/mol
LogP-3.63
Rot. Bonds6

About 6-amino-3-[(1R)-2,3-dihydroxy-1-(2-hydroxyethoxy)propyl]-1H-1,3,5-triazine-2,4-dione

6-amino-3-[(1R)-2,3-dihydroxy-1-(2-hydroxyethoxy)propyl]-1H-1,3,5-triazine-2,4-dione (PubChem CID 70927151) has the molecular formula C8H14N4O6 and a molecular weight of 262.22 g/mol. Its IUPAC name is 6-amino-3-[(1R)-2,3-dihydroxy-1-(2-hydroxyethoxy)propyl]-1H-1,3,5-triazine-2,4-dione.

Molecular Properties

Compound Name6-amino-3-[(1R)-2,3-dihydroxy-1-(2-hydroxyethoxy)propyl]-1H-1,3,5-triazine-2,4-dione
PubChem CID70927151
Molecular FormulaC8H14N4O6
Molecular Weight262.22 g/mol
Exact Mass262.09
IUPAC Name6-amino-3-[(1R)-2,3-dihydroxy-1-(2-hydroxyethoxy)propyl]-1H-1,3,5-triazine-2,4-dione
SMILESNc1nc(=O)n([C@H](OCCO)C(O)CO)c(=O)[nH]1
InChIInChI=1S/C8H14N4O6/c9-6-10-7(16)12(8(17)11-6)5(4(15)3-14)18-2-1-13/h4-5,13-15H,1-3H2,(H3,9,10,11,16,17)/t4?,5-/m1/s1
InChIKeySNYSKUMEKAJWSO-BRJRFNKRSA-N
XLogP-3.63
TPSA163.69 Ų
H-Bond Donors5
H-Bond Acceptors9
Rotatable Bonds6
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500262.22
LogP ≤ 5-3.63
H-Bond Donors ≤ 55
H-Bond Acceptors ≤ 109

Analyze 6-amino-3-[(1R)-2,3-dihydroxy-1-(2-hydroxyethoxy)propyl]-1H-1,3,5-triazine-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 6-amino-3-[(1R)-2,3-dihydroxy-1-(2-hydroxyethoxy)propyl]-1H-1,3,5-triazine-2,4-dione?
The IUPAC name of 6-amino-3-[(1R)-2,3-dihydroxy-1-(2-hydroxyethoxy)propyl]-1H-1,3,5-triazine-2,4-dione (CID 70927151) is 6-amino-3-[(1R)-2,3-dihydroxy-1-(2-hydroxyethoxy)propyl]-1H-1,3,5-triazine-2,4-dione.
What is the SMILES notation for 6-amino-3-[(1R)-2,3-dihydroxy-1-(2-hydroxyethoxy)propyl]-1H-1,3,5-triazine-2,4-dione?
The canonical SMILES for 6-amino-3-[(1R)-2,3-dihydroxy-1-(2-hydroxyethoxy)propyl]-1H-1,3,5-triazine-2,4-dione is Nc1nc(=O)n([C@H](OCCO)C(O)CO)c(=O)[nH]1.
What is the InChIKey of 6-amino-3-[(1R)-2,3-dihydroxy-1-(2-hydroxyethoxy)propyl]-1H-1,3,5-triazine-2,4-dione?
The InChIKey is SNYSKUMEKAJWSO-BRJRFNKRSA-N. The full InChI is InChI=1S/C8H14N4O6/c9-6-10-7(16)12(8(17)11-6)5(4(15)3-14)18-2-1-13/h4-5,13-15H,1-3H2,(H3,9,10,11,16,17)/t4?,5-/m1/s1.
What are the key properties of 6-amino-3-[(1R)-2,3-dihydroxy-1-(2-hydroxyethoxy)propyl]-1H-1,3,5-triazine-2,4-dione?
6-amino-3-[(1R)-2,3-dihydroxy-1-(2-hydroxyethoxy)propyl]-1H-1,3,5-triazine-2,4-dione has a molecular weight of 262.22 g/mol, XLogP of -3.63, 6 rotatable bonds, 5 hydrogen bond donors, and 9 hydrogen bond acceptors.
Where does this data come from?
All data for 6-amino-3-[(1R)-2,3-dihydroxy-1-(2-hydroxyethoxy)propyl]-1H-1,3,5-triazine-2,4-dione is sourced from PubChem (CID 70927151), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).