(2S)-2-(aminomethyl)bicyclo[2.2.2]octan-2-amine;dichloroplatinum

C9H18Cl2N2Pt — CID 18652616

IUPAC(2S)-2-(aminomethyl)bicyclo[2.2.2]octan-2-amine;dichloroplatinum
SMILESCl[Pt]Cl.NC[C@]1(N)CC2CCC1CC2
InChIInChI=1S/C9H18N2.2ClH.Pt/c10-6-9(11)5-7-1-3-8(9)4-2-7;;;/h7-8H,1-6,10-11H2;2*1H;/q;;;+2/p-2/t7?,8?,9-;;;/m1.../s1
InChIKeyACUGJZCOBWNCON-BHVPSMCNSA-L
MW420.24 g/mol
LogP2.23
Rot. Bonds1

About (2S)-2-(aminomethyl)bicyclo[2.2.2]octan-2-amine;dichloroplatinum

(2S)-2-(aminomethyl)bicyclo[2.2.2]octan-2-amine;dichloroplatinum (PubChem CID 18652616) has the molecular formula C9H18Cl2N2Pt and a molecular weight of 420.24 g/mol. Its IUPAC name is (2S)-2-(aminomethyl)bicyclo[2.2.2]octan-2-amine;dichloroplatinum.

Molecular Properties

Compound Name(2S)-2-(aminomethyl)bicyclo[2.2.2]octan-2-amine;dichloroplatinum
PubChem CID18652616
Molecular FormulaC9H18Cl2N2Pt
Molecular Weight420.24 g/mol
Exact Mass419.05
IUPAC Name(2S)-2-(aminomethyl)bicyclo[2.2.2]octan-2-amine;dichloroplatinum
SMILESCl[Pt]Cl.NC[C@]1(N)CC2CCC1CC2
InChIInChI=1S/C9H18N2.2ClH.Pt/c10-6-9(11)5-7-1-3-8(9)4-2-7;;;/h7-8H,1-6,10-11H2;2*1H;/q;;;+2/p-2/t7?,8?,9-;;;/m1.../s1
InChIKeyACUGJZCOBWNCON-BHVPSMCNSA-L
XLogP2.23
TPSA52.04 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds1
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500420.24
LogP ≤ 52.23
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of (2S)-2-(aminomethyl)bicyclo[2.2.2]octan-2-amine;dichloroplatinum?
The IUPAC name of (2S)-2-(aminomethyl)bicyclo[2.2.2]octan-2-amine;dichloroplatinum (CID 18652616) is (2S)-2-(aminomethyl)bicyclo[2.2.2]octan-2-amine;dichloroplatinum.
What is the SMILES notation for (2S)-2-(aminomethyl)bicyclo[2.2.2]octan-2-amine;dichloroplatinum?
The canonical SMILES for (2S)-2-(aminomethyl)bicyclo[2.2.2]octan-2-amine;dichloroplatinum is Cl[Pt]Cl.NC[C@]1(N)CC2CCC1CC2.
What is the InChIKey of (2S)-2-(aminomethyl)bicyclo[2.2.2]octan-2-amine;dichloroplatinum?
The InChIKey is ACUGJZCOBWNCON-BHVPSMCNSA-L. The full InChI is InChI=1S/C9H18N2.2ClH.Pt/c10-6-9(11)5-7-1-3-8(9)4-2-7;;;/h7-8H,1-6,10-11H2;2*1H;/q;;;+2/p-2/t7?,8?,9-;;;/m1.../s1.
What are the key properties of (2S)-2-(aminomethyl)bicyclo[2.2.2]octan-2-amine;dichloroplatinum?
(2S)-2-(aminomethyl)bicyclo[2.2.2]octan-2-amine;dichloroplatinum has a molecular weight of 420.24 g/mol, XLogP of 2.23, 1 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for (2S)-2-(aminomethyl)bicyclo[2.2.2]octan-2-amine;dichloroplatinum is sourced from PubChem (CID 18652616), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).