5,9-dimethyl-2,5,9-triaza-7λ4-platinatricyclo[6.4.0.02,6]dodeca-1(12),3,6,7,10-pentaene

C10H11N3Pt — CID 158567715

IUPAC5,9-dimethyl-2,5,9-triaza-7λ4-platinatricyclo[6.4.0.02,6]dodeca-1(12),3,6,7,10-pentaene
SMILESCN1C=CC=C2C1=[Pt]=C1N(C)C=CN21
InChIInChI=1S/C10H11N3.Pt/c1-11-5-3-4-10(8-11)13-7-6-12(2)9-13;/h3-7H,1-2H3;
InChIKeyPLOBTIAFMNTIIX-UHFFFAOYSA-N
MW368.30 g/mol
LogP0.36
Rot. Bonds

About 5,9-dimethyl-2,5,9-triaza-7λ4-platinatricyclo[6.4.0.02,6]dodeca-1(12),3,6,7,10-pentaene

5,9-dimethyl-2,5,9-triaza-7λ4-platinatricyclo[6.4.0.02,6]dodeca-1(12),3,6,7,10-pentaene (PubChem CID 158567715) has the molecular formula C10H11N3Pt and a molecular weight of 368.30 g/mol. Its IUPAC name is 5,9-dimethyl-2,5,9-triaza-7λ4-platinatricyclo[6.4.0.02,6]dodeca-1(12),3,6,7,10-pentaene.

Molecular Properties

Compound Name5,9-dimethyl-2,5,9-triaza-7λ4-platinatricyclo[6.4.0.02,6]dodeca-1(12),3,6,7,10-pentaene
PubChem CID158567715
Molecular FormulaC10H11N3Pt
Molecular Weight368.30 g/mol
Exact Mass368.06
IUPAC Name5,9-dimethyl-2,5,9-triaza-7λ4-platinatricyclo[6.4.0.02,6]dodeca-1(12),3,6,7,10-pentaene
SMILESCN1C=CC=C2C1=[Pt]=C1N(C)C=CN21
InChIInChI=1S/C10H11N3.Pt/c1-11-5-3-4-10(8-11)13-7-6-12(2)9-13;/h3-7H,1-2H3;
InChIKeyPLOBTIAFMNTIIX-UHFFFAOYSA-N
XLogP0.36
TPSA9.72 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500368.30
LogP ≤ 50.36
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 5,9-dimethyl-2,5,9-triaza-7λ4-platinatricyclo[6.4.0.02,6]dodeca-1(12),3,6,7,10-pentaene?
The IUPAC name of 5,9-dimethyl-2,5,9-triaza-7λ4-platinatricyclo[6.4.0.02,6]dodeca-1(12),3,6,7,10-pentaene (CID 158567715) is 5,9-dimethyl-2,5,9-triaza-7λ4-platinatricyclo[6.4.0.02,6]dodeca-1(12),3,6,7,10-pentaene.
What is the SMILES notation for 5,9-dimethyl-2,5,9-triaza-7λ4-platinatricyclo[6.4.0.02,6]dodeca-1(12),3,6,7,10-pentaene?
The canonical SMILES for 5,9-dimethyl-2,5,9-triaza-7λ4-platinatricyclo[6.4.0.02,6]dodeca-1(12),3,6,7,10-pentaene is CN1C=CC=C2C1=[Pt]=C1N(C)C=CN21.
What is the InChIKey of 5,9-dimethyl-2,5,9-triaza-7λ4-platinatricyclo[6.4.0.02,6]dodeca-1(12),3,6,7,10-pentaene?
The InChIKey is PLOBTIAFMNTIIX-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H11N3.Pt/c1-11-5-3-4-10(8-11)13-7-6-12(2)9-13;/h3-7H,1-2H3;.
What are the key properties of 5,9-dimethyl-2,5,9-triaza-7λ4-platinatricyclo[6.4.0.02,6]dodeca-1(12),3,6,7,10-pentaene?
5,9-dimethyl-2,5,9-triaza-7λ4-platinatricyclo[6.4.0.02,6]dodeca-1(12),3,6,7,10-pentaene has a molecular weight of 368.30 g/mol, XLogP of 0.36, 0 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 5,9-dimethyl-2,5,9-triaza-7λ4-platinatricyclo[6.4.0.02,6]dodeca-1(12),3,6,7,10-pentaene is sourced from PubChem (CID 158567715), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).