methane;triazine

C4H7N3 — CID 68741300

IUPACmethane;triazine
SMILESC.c1cnnnc1
InChIInChI=1S/C3H3N3.CH4/c1-2-4-6-5-3-1;/h1-3H;1H4
InChIKeyYJWCGCBCOCLFPX-UHFFFAOYSA-N
MW97.12 g/mol
LogP0.51
Rot. Bonds

About methane;triazine

methane;triazine (PubChem CID 68741300) has the molecular formula C4H7N3 and a molecular weight of 97.12 g/mol. Its IUPAC name is methane;triazine.

Molecular Properties

Compound Namemethane;triazine
PubChem CID68741300
Molecular FormulaC4H7N3
Molecular Weight97.12 g/mol
Exact Mass97.06
IUPAC Namemethane;triazine
SMILESC.c1cnnnc1
InChIInChI=1S/C3H3N3.CH4/c1-2-4-6-5-3-1;/h1-3H;1H4
InChIKeyYJWCGCBCOCLFPX-UHFFFAOYSA-N
XLogP0.51
TPSA38.67 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds
Heavy Atoms7
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 50097.12
LogP ≤ 50.51
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of methane;triazine?
The IUPAC name of methane;triazine (CID 68741300) is methane;triazine.
What is the SMILES notation for methane;triazine?
The canonical SMILES for methane;triazine is C.c1cnnnc1.
What is the InChIKey of methane;triazine?
The InChIKey is YJWCGCBCOCLFPX-UHFFFAOYSA-N. The full InChI is InChI=1S/C3H3N3.CH4/c1-2-4-6-5-3-1;/h1-3H;1H4.
What are the key properties of methane;triazine?
methane;triazine has a molecular weight of 97.12 g/mol, XLogP of 0.51, 0 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for methane;triazine is sourced from PubChem (CID 68741300), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).