6-(2-hydroxyethylamino)-1H-1,3,5-triazine-2,4-dione

Name: 6-(2-hydroxyethylamino)-1H-1,3,5-triazine-2,4-dione — Molecular Data
Creator: MolForge
License: https://creativecommons.org/publicdomain/zero/1.0/

C₅H₈N₄O₃ — CID 71392003

Data last refreshed: 2026-04-15 (MolForge compound catalog, from PubChem)

IUPAC6-(2-hydroxyethylamino)-1H-1,3,5-triazine-2,4-dione

SMILESO=c1nc(NCCO)[nH]c(=O)[nH]1

InChIInChI=1S/C5H8N4O3/c10-2-1-6-3-7-4(11)9-5(12)8-3/h10H,1-2H2,(H3,6,7,8,9,11,12)

InChIKeyIGWPESAZNAWAFW-UHFFFAOYSA-N

MW172.14 g/mol

LogP-2.14

Rot. Bonds3

About 6-(2-hydroxyethylamino)-1H-1,3,5-triazine-2,4-dione

6-(2-hydroxyethylamino)-1H-1,3,5-triazine-2,4-dione (PubChem CID 71392003) has the molecular formula C₅H₈N₄O₃ and a molecular weight of 172.14 g/mol. Its IUPAC name is 6-(2-hydroxyethylamino)-1H-1,3,5-triazine-2,4-dione.

Molecular Properties

Compound Name	6-(2-hydroxyethylamino)-1H-1,3,5-triazine-2,4-dione
PubChem CID	71392003
Molecular Formula	C₅H₈N₄O₃
Molecular Weight	172.14 g/mol
Exact Mass	172.06
IUPAC Name	6-(2-hydroxyethylamino)-1H-1,3,5-triazine-2,4-dione
SMILES	O=c1nc(NCCO)[nH]c(=O)[nH]1
InChI	InChI=1S/C5H8N4O3/c10-2-1-6-3-7-4(11)9-5(12)8-3/h10H,1-2H2,(H3,6,7,8,9,11,12)
InChIKey	IGWPESAZNAWAFW-UHFFFAOYSA-N
XLogP	-2.14
TPSA	110.87 Å²
H-Bond Donors	4
H-Bond Acceptors	5
Rotatable Bonds	3
Heavy Atoms	12
Complexity	—

Lipinski Rule of Five

Passes Rule of Five

Rule	Value
MW ≤ 500	172.14
LogP ≤ 5	-2.14
H-Bond Donors ≤ 5	4
H-Bond Acceptors ≤ 10	5

Frequently Asked Questions

What is the IUPAC name of 6-(2-hydroxyethylamino)-1H-1,3,5-triazine-2,4-dione?

The IUPAC name of 6-(2-hydroxyethylamino)-1H-1,3,5-triazine-2,4-dione (CID 71392003) is 6-(2-hydroxyethylamino)-1H-1,3,5-triazine-2,4-dione.

What is the SMILES notation for 6-(2-hydroxyethylamino)-1H-1,3,5-triazine-2,4-dione?

The canonical SMILES for 6-(2-hydroxyethylamino)-1H-1,3,5-triazine-2,4-dione is O=c1nc(NCCO)[nH]c(=O)[nH]1.

What is the InChIKey of 6-(2-hydroxyethylamino)-1H-1,3,5-triazine-2,4-dione?

The InChIKey is IGWPESAZNAWAFW-UHFFFAOYSA-N. The full InChI is InChI=1S/C5H8N4O3/c10-2-1-6-3-7-4(11)9-5(12)8-3/h10H,1-2H2,(H3,6,7,8,9,11,12).

What are the key properties of 6-(2-hydroxyethylamino)-1H-1,3,5-triazine-2,4-dione?

6-(2-hydroxyethylamino)-1H-1,3,5-triazine-2,4-dione has a molecular weight of 172.14 g/mol, XLogP of -2.14, 3 rotatable bonds, 4 hydrogen bond donors, and 5 hydrogen bond acceptors.

Where does this data come from?

All data for 6-(2-hydroxyethylamino)-1H-1,3,5-triazine-2,4-dione is sourced from PubChem (CID 71392003), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).

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Sources

PubChem CID 71392003 — identifiers, structure, computed properties (public domain)

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