prop-2-en-1-ol;1,3,5-triazine

C6H9N3O — CID 174415460

IUPACprop-2-en-1-ol;1,3,5-triazine
SMILESC=CCO.c1ncncn1
InChIInChI=1S/C3H3N3.C3H6O/c1-4-2-6-3-5-1;1-2-3-4/h1-3H;2,4H,1,3H2
InChIKeyICXUASGCUKGYRR-UHFFFAOYSA-N
MW139.16 g/mol
LogP0.04
Rot. Bonds1

About prop-2-en-1-ol;1,3,5-triazine

prop-2-en-1-ol;1,3,5-triazine (PubChem CID 174415460) has the molecular formula C6H9N3O and a molecular weight of 139.16 g/mol. Its IUPAC name is prop-2-en-1-ol;1,3,5-triazine.

Molecular Properties

Compound Nameprop-2-en-1-ol;1,3,5-triazine
PubChem CID174415460
Molecular FormulaC6H9N3O
Molecular Weight139.16 g/mol
Exact Mass139.07
IUPAC Nameprop-2-en-1-ol;1,3,5-triazine
SMILESC=CCO.c1ncncn1
InChIInChI=1S/C3H3N3.C3H6O/c1-4-2-6-3-5-1;1-2-3-4/h1-3H;2,4H,1,3H2
InChIKeyICXUASGCUKGYRR-UHFFFAOYSA-N
XLogP0.04
TPSA58.90 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds1
Heavy Atoms10
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500139.16
LogP ≤ 50.04
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'isolated_alkene', 'substructure': 'N/A'}

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Related Compounds

prop-2-en-1-ol;stannane
CID 173011847
tris(prop-2-en-1-ol);titanium
CID 177430302
palladium;prop-2-en-1-ol
CID 174738177
tetrakis(prop-2-en-1-ol);titanium
CID 87784373
alumane;prop-2-en-1-ol
CID 173215342
methane;prop-2-en-1-ol;fluoride;hydroxide;hydrate
CID 161314513
ethenol;prop-2-en-1-ol;titanium;dihydrate
CID 88804274
tris(prop-2-enamide);1,3,5-triazine
CID 70620459
ethenol;oxotitanium;prop-2-en-1-ol
CID 88804275
1,3-dichloroprop-1-ene;prop-2-en-1-ol
CID 174971735
oxirane;prop-2-en-1-ol;hydrate
CID 175380970
ethenol;pyrimidine
CID 174498659

Frequently Asked Questions

What is the IUPAC name of prop-2-en-1-ol;1,3,5-triazine?
The IUPAC name of prop-2-en-1-ol;1,3,5-triazine (CID 174415460) is prop-2-en-1-ol;1,3,5-triazine.
What is the SMILES notation for prop-2-en-1-ol;1,3,5-triazine?
The canonical SMILES for prop-2-en-1-ol;1,3,5-triazine is C=CCO.c1ncncn1.
What is the InChIKey of prop-2-en-1-ol;1,3,5-triazine?
The InChIKey is ICXUASGCUKGYRR-UHFFFAOYSA-N. The full InChI is InChI=1S/C3H3N3.C3H6O/c1-4-2-6-3-5-1;1-2-3-4/h1-3H;2,4H,1,3H2.
What are the key properties of prop-2-en-1-ol;1,3,5-triazine?
prop-2-en-1-ol;1,3,5-triazine has a molecular weight of 139.16 g/mol, XLogP of 0.04, 1 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for prop-2-en-1-ol;1,3,5-triazine is sourced from PubChem (CID 174415460), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).