methanol;1,3,5-triazine-2,4,6-triamine

C4H10N6O — CID 23304119

IUPACmethanol;1,3,5-triazine-2,4,6-triamine
SMILESCO.Nc1nc(N)nc(N)n1
InChIInChI=1S/C3H6N6.CH4O/c4-1-7-2(5)9-3(6)8-1;1-2/h(H6,4,5,6,7,8,9);2H,1H3
InChIKeyLXEKVMQAXWKLPJ-UHFFFAOYSA-N
MW158.17 g/mol
LogP-1.77
Rot. Bonds

About methanol;1,3,5-triazine-2,4,6-triamine

methanol;1,3,5-triazine-2,4,6-triamine (PubChem CID 23304119) has the molecular formula C4H10N6O and a molecular weight of 158.17 g/mol. Its IUPAC name is methanol;1,3,5-triazine-2,4,6-triamine.

Molecular Properties

Compound Namemethanol;1,3,5-triazine-2,4,6-triamine
PubChem CID23304119
Molecular FormulaC4H10N6O
Molecular Weight158.17 g/mol
Exact Mass158.09
IUPAC Namemethanol;1,3,5-triazine-2,4,6-triamine
SMILESCO.Nc1nc(N)nc(N)n1
InChIInChI=1S/C3H6N6.CH4O/c4-1-7-2(5)9-3(6)8-1;1-2/h(H6,4,5,6,7,8,9);2H,1H3
InChIKeyLXEKVMQAXWKLPJ-UHFFFAOYSA-N
XLogP-1.77
TPSA136.96 Ų
H-Bond Donors4
H-Bond Acceptors7
Rotatable Bonds
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500158.17
LogP ≤ 5-1.77
H-Bond Donors ≤ 54
H-Bond Acceptors ≤ 107

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Frequently Asked Questions

What is the IUPAC name of methanol;1,3,5-triazine-2,4,6-triamine?
The IUPAC name of methanol;1,3,5-triazine-2,4,6-triamine (CID 23304119) is methanol;1,3,5-triazine-2,4,6-triamine.
What is the SMILES notation for methanol;1,3,5-triazine-2,4,6-triamine?
The canonical SMILES for methanol;1,3,5-triazine-2,4,6-triamine is CO.Nc1nc(N)nc(N)n1.
What is the InChIKey of methanol;1,3,5-triazine-2,4,6-triamine?
The InChIKey is LXEKVMQAXWKLPJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C3H6N6.CH4O/c4-1-7-2(5)9-3(6)8-1;1-2/h(H6,4,5,6,7,8,9);2H,1H3.
What are the key properties of methanol;1,3,5-triazine-2,4,6-triamine?
methanol;1,3,5-triazine-2,4,6-triamine has a molecular weight of 158.17 g/mol, XLogP of -1.77, 0 rotatable bonds, 4 hydrogen bond donors, and 7 hydrogen bond acceptors.
Where does this data come from?
All data for methanol;1,3,5-triazine-2,4,6-triamine is sourced from PubChem (CID 23304119), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).