1-(4-amino-1,3,5-triazin-2-yl)ethanol

C5H8N4O — CID 67256070

IUPAC1-(4-amino-1,3,5-triazin-2-yl)ethanol
SMILESCC(O)c1ncnc(N)n1
InChIInChI=1S/C5H8N4O/c1-3(10)4-7-2-8-5(6)9-4/h2-3,10H,1H3,(H2,6,7,8,9)
InChIKeyCVYLSMBJRJNQHP-UHFFFAOYSA-N
MW140.15 g/mol
LogP-0.49
Rot. Bonds1

About 1-(4-amino-1,3,5-triazin-2-yl)ethanol

1-(4-amino-1,3,5-triazin-2-yl)ethanol (PubChem CID 67256070) has the molecular formula C5H8N4O and a molecular weight of 140.15 g/mol. Its IUPAC name is 1-(4-amino-1,3,5-triazin-2-yl)ethanol.

Molecular Properties

Compound Name1-(4-amino-1,3,5-triazin-2-yl)ethanol
PubChem CID67256070
Molecular FormulaC5H8N4O
Molecular Weight140.15 g/mol
Exact Mass140.07
IUPAC Name1-(4-amino-1,3,5-triazin-2-yl)ethanol
SMILESCC(O)c1ncnc(N)n1
InChIInChI=1S/C5H8N4O/c1-3(10)4-7-2-8-5(6)9-4/h2-3,10H,1H3,(H2,6,7,8,9)
InChIKeyCVYLSMBJRJNQHP-UHFFFAOYSA-N
XLogP-0.49
TPSA84.92 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds1
Heavy Atoms10
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500140.15
LogP ≤ 5-0.49
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

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Frequently Asked Questions

What is the IUPAC name of 1-(4-amino-1,3,5-triazin-2-yl)ethanol?
The IUPAC name of 1-(4-amino-1,3,5-triazin-2-yl)ethanol (CID 67256070) is 1-(4-amino-1,3,5-triazin-2-yl)ethanol.
What is the SMILES notation for 1-(4-amino-1,3,5-triazin-2-yl)ethanol?
The canonical SMILES for 1-(4-amino-1,3,5-triazin-2-yl)ethanol is CC(O)c1ncnc(N)n1.
What is the InChIKey of 1-(4-amino-1,3,5-triazin-2-yl)ethanol?
The InChIKey is CVYLSMBJRJNQHP-UHFFFAOYSA-N. The full InChI is InChI=1S/C5H8N4O/c1-3(10)4-7-2-8-5(6)9-4/h2-3,10H,1H3,(H2,6,7,8,9).
What are the key properties of 1-(4-amino-1,3,5-triazin-2-yl)ethanol?
1-(4-amino-1,3,5-triazin-2-yl)ethanol has a molecular weight of 140.15 g/mol, XLogP of -0.49, 1 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(4-amino-1,3,5-triazin-2-yl)ethanol is sourced from PubChem (CID 67256070), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).