platinum(2+);trimethyl-(1-methylcyclopenta-2,4-dien-1-yl)azanium

C9H16NPt+3 — CID 160543488

IUPACplatinum(2+);trimethyl-(1-methylcyclopenta-2,4-dien-1-yl)azanium
SMILESCC1([N+](C)(C)C)C=CC=C1.[Pt+2]
InChIInChI=1S/C9H16N.Pt/c1-9(10(2,3)4)7-5-6-8-9;/h5-8H,1-4H3;/q+1;+2
InChIKeyQXCJGLBYOGHOBM-UHFFFAOYSA-N
MW333.31 g/mol
LogP1.57
Rot. Bonds1

About platinum(2+);trimethyl-(1-methylcyclopenta-2,4-dien-1-yl)azanium

platinum(2+);trimethyl-(1-methylcyclopenta-2,4-dien-1-yl)azanium (PubChem CID 160543488) has the molecular formula C9H16NPt+3 and a molecular weight of 333.31 g/mol. Its IUPAC name is platinum(2+);trimethyl-(1-methylcyclopenta-2,4-dien-1-yl)azanium.

Molecular Properties

Compound Nameplatinum(2+);trimethyl-(1-methylcyclopenta-2,4-dien-1-yl)azanium
PubChem CID160543488
Molecular FormulaC9H16NPt+3
Molecular Weight333.31 g/mol
Exact Mass333.09
IUPAC Nameplatinum(2+);trimethyl-(1-methylcyclopenta-2,4-dien-1-yl)azanium
SMILESCC1([N+](C)(C)C)C=CC=C1.[Pt+2]
InChIInChI=1S/C9H16N.Pt/c1-9(10(2,3)4)7-5-6-8-9;/h5-8H,1-4H3;/q+1;+2
InChIKeyQXCJGLBYOGHOBM-UHFFFAOYSA-N
XLogP1.57
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds1
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500333.31
LogP ≤ 51.57
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 100

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'quaternary_nitrogen_2', 'substructure': 'N/A'}

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Related Compounds

2-Methyl-2-Dimethylaminopenten
CID 129647855
(5Z)-5-ethylidene-1,2,2-trimethylpyrrole
CID 135038931
1,2,2,5,5-Pentamethylpyrrole
CID 22946773
1-Tert-butyl-2,5-dimethyl-2,5-dihydropyrrole
CID 59603290
lithium 2-cyclopenta-1,4-dien-1-yl-N,N-dimethylpropan-2-amine
CID 88223235
(3Z,5Z,7Z,9Z)-N,N,2,6-tetramethylundeca-1,3,5,7,9-pentaen-5-amine
CID 88565366
(3Z,5Z,7Z)-N,N,3-trimethylnona-3,5,7-trien-4-amine
CID 89002983
(3E)-N-ethyl-N,2,4,5-tetramethylhexa-3,5-dien-2-amine
CID 117894063
1-Tert-butyl-2-methyl-2,5-dihydropyrrole
CID 122412913
(3Z,5E)-N,N,2-trimethylhepta-3,5-dien-2-amine
CID 124196451
N,N,1,2-tetramethylcyclopenta-2,4-dien-1-amine
CID 124196454
(3Z)-N-tert-butyl-N-methylhexa-1,3-dien-2-amine
CID 126703146

Frequently Asked Questions

What is the IUPAC name of platinum(2+);trimethyl-(1-methylcyclopenta-2,4-dien-1-yl)azanium?
The IUPAC name of platinum(2+);trimethyl-(1-methylcyclopenta-2,4-dien-1-yl)azanium (CID 160543488) is platinum(2+);trimethyl-(1-methylcyclopenta-2,4-dien-1-yl)azanium.
What is the SMILES notation for platinum(2+);trimethyl-(1-methylcyclopenta-2,4-dien-1-yl)azanium?
The canonical SMILES for platinum(2+);trimethyl-(1-methylcyclopenta-2,4-dien-1-yl)azanium is CC1([N+](C)(C)C)C=CC=C1.[Pt+2].
What is the InChIKey of platinum(2+);trimethyl-(1-methylcyclopenta-2,4-dien-1-yl)azanium?
The InChIKey is QXCJGLBYOGHOBM-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H16N.Pt/c1-9(10(2,3)4)7-5-6-8-9;/h5-8H,1-4H3;/q+1;+2.
What are the key properties of platinum(2+);trimethyl-(1-methylcyclopenta-2,4-dien-1-yl)azanium?
platinum(2+);trimethyl-(1-methylcyclopenta-2,4-dien-1-yl)azanium has a molecular weight of 333.31 g/mol, XLogP of 1.57, 1 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for platinum(2+);trimethyl-(1-methylcyclopenta-2,4-dien-1-yl)azanium is sourced from PubChem (CID 160543488), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).