azane;molybdenum(4+);1,3,5-triazine-2,4,6-triamine

C3H9MoN7+4 — CID 172706405

IUPACazane;molybdenum(4+);1,3,5-triazine-2,4,6-triamine
SMILESN.Nc1nc(N)nc(N)n1.[Mo+4]
InChIInChI=1S/C3H6N6.Mo.H3N/c4-1-7-2(5)9-3(6)8-1;;/h(H6,4,5,6,7,8,9);;1H3/q;+4;
InChIKeyDQLMYJDMRBUPBS-UHFFFAOYSA-N
MW239.09 g/mol
LogP-1.22
Rot. Bonds

About azane;molybdenum(4+);1,3,5-triazine-2,4,6-triamine

azane;molybdenum(4+);1,3,5-triazine-2,4,6-triamine (PubChem CID 172706405) has the molecular formula C3H9MoN7+4 and a molecular weight of 239.09 g/mol. Its IUPAC name is azane;molybdenum(4+);1,3,5-triazine-2,4,6-triamine.

Molecular Properties

Compound Nameazane;molybdenum(4+);1,3,5-triazine-2,4,6-triamine
PubChem CID172706405
Molecular FormulaC3H9MoN7+4
Molecular Weight239.09 g/mol
Exact Mass241.00
IUPAC Nameazane;molybdenum(4+);1,3,5-triazine-2,4,6-triamine
SMILESN.Nc1nc(N)nc(N)n1.[Mo+4]
InChIInChI=1S/C3H6N6.Mo.H3N/c4-1-7-2(5)9-3(6)8-1;;/h(H6,4,5,6,7,8,9);;1H3/q;+4;
InChIKeyDQLMYJDMRBUPBS-UHFFFAOYSA-N
XLogP-1.22
TPSA151.73 Ų
H-Bond Donors4
H-Bond Acceptors7
Rotatable Bonds
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500239.09
LogP ≤ 5-1.22
H-Bond Donors ≤ 54
H-Bond Acceptors ≤ 107

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Related Compounds

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Frequently Asked Questions

What is the IUPAC name of azane;molybdenum(4+);1,3,5-triazine-2,4,6-triamine?
The IUPAC name of azane;molybdenum(4+);1,3,5-triazine-2,4,6-triamine (CID 172706405) is azane;molybdenum(4+);1,3,5-triazine-2,4,6-triamine.
What is the SMILES notation for azane;molybdenum(4+);1,3,5-triazine-2,4,6-triamine?
The canonical SMILES for azane;molybdenum(4+);1,3,5-triazine-2,4,6-triamine is N.Nc1nc(N)nc(N)n1.[Mo+4].
What is the InChIKey of azane;molybdenum(4+);1,3,5-triazine-2,4,6-triamine?
The InChIKey is DQLMYJDMRBUPBS-UHFFFAOYSA-N. The full InChI is InChI=1S/C3H6N6.Mo.H3N/c4-1-7-2(5)9-3(6)8-1;;/h(H6,4,5,6,7,8,9);;1H3/q;+4;.
What are the key properties of azane;molybdenum(4+);1,3,5-triazine-2,4,6-triamine?
azane;molybdenum(4+);1,3,5-triazine-2,4,6-triamine has a molecular weight of 239.09 g/mol, XLogP of -1.22, 0 rotatable bonds, 4 hydrogen bond donors, and 7 hydrogen bond acceptors.
Where does this data come from?
All data for azane;molybdenum(4+);1,3,5-triazine-2,4,6-triamine is sourced from PubChem (CID 172706405), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).