methanol;1,3,5-triazine

C4H7N3O — CID 158960503

IUPACmethanol;1,3,5-triazine
SMILESCO.c1ncncn1
InChIInChI=1S/C3H3N3.CH4O/c1-4-2-6-3-5-1;1-2/h1-3H;2H,1H3
InChIKeyJMOGFQGFOYDUSU-UHFFFAOYSA-N
MW113.12 g/mol
LogP-0.52
Rot. Bonds

About methanol;1,3,5-triazine

methanol;1,3,5-triazine (PubChem CID 158960503) has the molecular formula C4H7N3O and a molecular weight of 113.12 g/mol. Its IUPAC name is methanol;1,3,5-triazine.

Molecular Properties

Compound Namemethanol;1,3,5-triazine
PubChem CID158960503
Molecular FormulaC4H7N3O
Molecular Weight113.12 g/mol
Exact Mass113.06
IUPAC Namemethanol;1,3,5-triazine
SMILESCO.c1ncncn1
InChIInChI=1S/C3H3N3.CH4O/c1-4-2-6-3-5-1;1-2/h1-3H;2H,1H3
InChIKeyJMOGFQGFOYDUSU-UHFFFAOYSA-N
XLogP-0.52
TPSA58.90 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds
Heavy Atoms8
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500113.12
LogP ≤ 5-0.52
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of methanol;1,3,5-triazine?
The IUPAC name of methanol;1,3,5-triazine (CID 158960503) is methanol;1,3,5-triazine.
What is the SMILES notation for methanol;1,3,5-triazine?
The canonical SMILES for methanol;1,3,5-triazine is CO.c1ncncn1.
What is the InChIKey of methanol;1,3,5-triazine?
The InChIKey is JMOGFQGFOYDUSU-UHFFFAOYSA-N. The full InChI is InChI=1S/C3H3N3.CH4O/c1-4-2-6-3-5-1;1-2/h1-3H;2H,1H3.
What are the key properties of methanol;1,3,5-triazine?
methanol;1,3,5-triazine has a molecular weight of 113.12 g/mol, XLogP of -0.52, 0 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for methanol;1,3,5-triazine is sourced from PubChem (CID 158960503), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).