cyclohexanamine;(2-methyl-5-phenyl-1H-1,2,4-triazol-3-ylidene)platinum

C15H22N4Pt — CID 160598722

IUPACcyclohexanamine;(2-methyl-5-phenyl-1H-1,2,4-triazol-3-ylidene)platinum
SMILESCn1[nH]c(-c2ccccc2)nc1=[Pt].NC1CCCCC1
InChIInChI=1S/C9H9N3.C6H13N.Pt/c1-12-7-10-9(11-12)8-5-3-2-4-6-8;7-6-4-2-1-3-5-6;/h2-6H,1H3,(H,10,11);6H,1-5,7H2;
InChIKeyRDZHWTPMVWKUOE-UHFFFAOYSA-N
MW453.45 g/mol
LogP2.77
Rot. Bonds1

About cyclohexanamine;(2-methyl-5-phenyl-1H-1,2,4-triazol-3-ylidene)platinum

cyclohexanamine;(2-methyl-5-phenyl-1H-1,2,4-triazol-3-ylidene)platinum (PubChem CID 160598722) has the molecular formula C15H22N4Pt and a molecular weight of 453.45 g/mol. Its IUPAC name is cyclohexanamine;(2-methyl-5-phenyl-1H-1,2,4-triazol-3-ylidene)platinum.

Molecular Properties

Compound Namecyclohexanamine;(2-methyl-5-phenyl-1H-1,2,4-triazol-3-ylidene)platinum
PubChem CID160598722
Molecular FormulaC15H22N4Pt
Molecular Weight453.45 g/mol
Exact Mass453.15
IUPAC Namecyclohexanamine;(2-methyl-5-phenyl-1H-1,2,4-triazol-3-ylidene)platinum
SMILESCn1[nH]c(-c2ccccc2)nc1=[Pt].NC1CCCCC1
InChIInChI=1S/C9H9N3.C6H13N.Pt/c1-12-7-10-9(11-12)8-5-3-2-4-6-8;7-6-4-2-1-3-5-6;/h2-6H,1H3,(H,10,11);6H,1-5,7H2;
InChIKeyRDZHWTPMVWKUOE-UHFFFAOYSA-N
XLogP2.77
TPSA59.63 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds1
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500453.45
LogP ≤ 52.77
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

Analyze cyclohexanamine;(2-methyl-5-phenyl-1H-1,2,4-triazol-3-ylidene)platinum with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

cyclohexanamine;diphenylmethanediamine
CID 175293358
(4R)-1-(6-methyl-2-phenylpyrimidin-4-yl)azepan-4-amine
CID 95723048
benzonitrile;cyclopentanamine
CID 162015022
cycloheptanamine;phenylmethanamine
CID 162192852
cyclohexanamine;3-methyl-2-phenylquinoline-4-carboxylic acid
CID 19715596
cyclohexanamine;pyridine
CID 22649715
1-methyl-3-phenyl-3a,4,5,6,7,7a-hexahydroindazole
CID 13153343
cyclohexyl-(2-methyl-5-phenyl-1,2,4-triazol-3-yl)methanamine
CID 62723083
N,N-dibromocyclohexanamine;(1,3-dimethyl-4,5-diphenylimidazol-2-ylidene)platinum
CID 87351879
2-(2-phenylimidazol-1-yl)cycloheptan-1-amine
CID 61070661
2-cycloheptyl-4-methyl-5-phenyl-1H-pyrazol-3-one
CID 104844889
N-cyclohexyl-2-phenyl-1H-imidazo[4,5-c]pyridin-4-amine
CID 129316282

Frequently Asked Questions

What is the IUPAC name of cyclohexanamine;(2-methyl-5-phenyl-1H-1,2,4-triazol-3-ylidene)platinum?
The IUPAC name of cyclohexanamine;(2-methyl-5-phenyl-1H-1,2,4-triazol-3-ylidene)platinum (CID 160598722) is cyclohexanamine;(2-methyl-5-phenyl-1H-1,2,4-triazol-3-ylidene)platinum.
What is the SMILES notation for cyclohexanamine;(2-methyl-5-phenyl-1H-1,2,4-triazol-3-ylidene)platinum?
The canonical SMILES for cyclohexanamine;(2-methyl-5-phenyl-1H-1,2,4-triazol-3-ylidene)platinum is Cn1[nH]c(-c2ccccc2)nc1=[Pt].NC1CCCCC1.
What is the InChIKey of cyclohexanamine;(2-methyl-5-phenyl-1H-1,2,4-triazol-3-ylidene)platinum?
The InChIKey is RDZHWTPMVWKUOE-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H9N3.C6H13N.Pt/c1-12-7-10-9(11-12)8-5-3-2-4-6-8;7-6-4-2-1-3-5-6;/h2-6H,1H3,(H,10,11);6H,1-5,7H2;.
What are the key properties of cyclohexanamine;(2-methyl-5-phenyl-1H-1,2,4-triazol-3-ylidene)platinum?
cyclohexanamine;(2-methyl-5-phenyl-1H-1,2,4-triazol-3-ylidene)platinum has a molecular weight of 453.45 g/mol, XLogP of 2.77, 1 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for cyclohexanamine;(2-methyl-5-phenyl-1H-1,2,4-triazol-3-ylidene)platinum is sourced from PubChem (CID 160598722), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).