ethane;methane;propane;1,3,5-triazine

C9H21N3 — CID 159481307

IUPACethane;methane;propane;1,3,5-triazine
SMILESC.CC.CCC.c1ncncn1
InChIInChI=1S/C3H3N3.C3H8.C2H6.CH4/c1-4-2-6-3-5-1;1-3-2;1-2;/h1-3H;3H2,1-2H3;1-2H3;1H4
InChIKeyLXAPDFGZFBBCHP-UHFFFAOYSA-N
MW171.29 g/mol
LogP2.95
Rot. Bonds

About ethane;methane;propane;1,3,5-triazine

ethane;methane;propane;1,3,5-triazine (PubChem CID 159481307) has the molecular formula C9H21N3 and a molecular weight of 171.29 g/mol. Its IUPAC name is ethane;methane;propane;1,3,5-triazine.

Molecular Properties

Compound Nameethane;methane;propane;1,3,5-triazine
PubChem CID159481307
Molecular FormulaC9H21N3
Molecular Weight171.29 g/mol
Exact Mass171.17
IUPAC Nameethane;methane;propane;1,3,5-triazine
SMILESC.CC.CCC.c1ncncn1
InChIInChI=1S/C3H3N3.C3H8.C2H6.CH4/c1-4-2-6-3-5-1;1-3-2;1-2;/h1-3H;3H2,1-2H3;1-2H3;1H4
InChIKeyLXAPDFGZFBBCHP-UHFFFAOYSA-N
XLogP2.95
TPSA38.67 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500171.29
LogP ≤ 52.95
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of ethane;methane;propane;1,3,5-triazine?
The IUPAC name of ethane;methane;propane;1,3,5-triazine (CID 159481307) is ethane;methane;propane;1,3,5-triazine.
What is the SMILES notation for ethane;methane;propane;1,3,5-triazine?
The canonical SMILES for ethane;methane;propane;1,3,5-triazine is C.CC.CCC.c1ncncn1.
What is the InChIKey of ethane;methane;propane;1,3,5-triazine?
The InChIKey is LXAPDFGZFBBCHP-UHFFFAOYSA-N. The full InChI is InChI=1S/C3H3N3.C3H8.C2H6.CH4/c1-4-2-6-3-5-1;1-3-2;1-2;/h1-3H;3H2,1-2H3;1-2H3;1H4.
What are the key properties of ethane;methane;propane;1,3,5-triazine?
ethane;methane;propane;1,3,5-triazine has a molecular weight of 171.29 g/mol, XLogP of 2.95, 0 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for ethane;methane;propane;1,3,5-triazine is sourced from PubChem (CID 159481307), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).