(2S)-2-(aminomethyl)bicyclo[2.2.1]heptan-2-amine;platinum(2+);dichloride

C8H16Cl2N2Pt — CID 11742035

IUPAC(2S)-2-(aminomethyl)bicyclo[2.2.1]heptan-2-amine;platinum(2+);dichloride
SMILESNC[C@]1(N)CC2CCC1C2.[Cl-].[Cl-].[Pt+2]
InChIInChI=1S/C8H16N2.2ClH.Pt/c9-5-8(10)4-6-1-2-7(8)3-6;;;/h6-7H,1-5,9-10H2;2*1H;/q;;;+2/p-2/t6?,7?,8-;;;/m1.../s1
InChIKeyJGVUFSFOCOWYLM-SLWLEEKJSA-L
MW406.21 g/mol
LogP-5.53
Rot. Bonds1

About (2S)-2-(aminomethyl)bicyclo[2.2.1]heptan-2-amine;platinum(2+);dichloride

(2S)-2-(aminomethyl)bicyclo[2.2.1]heptan-2-amine;platinum(2+);dichloride (PubChem CID 11742035) has the molecular formula C8H16Cl2N2Pt and a molecular weight of 406.21 g/mol. Its IUPAC name is (2S)-2-(aminomethyl)bicyclo[2.2.1]heptan-2-amine;platinum(2+);dichloride.

Molecular Properties

Compound Name(2S)-2-(aminomethyl)bicyclo[2.2.1]heptan-2-amine;platinum(2+);dichloride
PubChem CID11742035
Molecular FormulaC8H16Cl2N2Pt
Molecular Weight406.21 g/mol
Exact Mass405.03
IUPAC Name(2S)-2-(aminomethyl)bicyclo[2.2.1]heptan-2-amine;platinum(2+);dichloride
SMILESNC[C@]1(N)CC2CCC1C2.[Cl-].[Cl-].[Pt+2]
InChIInChI=1S/C8H16N2.2ClH.Pt/c9-5-8(10)4-6-1-2-7(8)3-6;;;/h6-7H,1-5,9-10H2;2*1H;/q;;;+2/p-2/t6?,7?,8-;;;/m1.../s1
InChIKeyJGVUFSFOCOWYLM-SLWLEEKJSA-L
XLogP-5.53
TPSA52.04 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds1
Heavy Atoms13
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500406.21
LogP ≤ 5-5.53
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[2.2.1]heptan-2-amine;platinum(2+);dichloride?
The IUPAC name of (2S)-2-(aminomethyl)bicyclo[2.2.1]heptan-2-amine;platinum(2+);dichloride (CID 11742035) is (2S)-2-(aminomethyl)bicyclo[2.2.1]heptan-2-amine;platinum(2+);dichloride.
What is the SMILES notation for (2S)-2-(aminomethyl)bicyclo[2.2.1]heptan-2-amine;platinum(2+);dichloride?
The canonical SMILES for (2S)-2-(aminomethyl)bicyclo[2.2.1]heptan-2-amine;platinum(2+);dichloride is NC[C@]1(N)CC2CCC1C2.[Cl-].[Cl-].[Pt+2].
What is the InChIKey of (2S)-2-(aminomethyl)bicyclo[2.2.1]heptan-2-amine;platinum(2+);dichloride?
The InChIKey is JGVUFSFOCOWYLM-SLWLEEKJSA-L. The full InChI is InChI=1S/C8H16N2.2ClH.Pt/c9-5-8(10)4-6-1-2-7(8)3-6;;;/h6-7H,1-5,9-10H2;2*1H;/q;;;+2/p-2/t6?,7?,8-;;;/m1.../s1.
What are the key properties of (2S)-2-(aminomethyl)bicyclo[2.2.1]heptan-2-amine;platinum(2+);dichloride?
(2S)-2-(aminomethyl)bicyclo[2.2.1]heptan-2-amine;platinum(2+);dichloride has a molecular weight of 406.21 g/mol, XLogP of -5.53, 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[2.2.1]heptan-2-amine;platinum(2+);dichloride is sourced from PubChem (CID 11742035), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).