(2R,3R)-2,3-dihydroxybutanedioate;platinum(2+);trans-(1R,2R)-cyclohexane-1,2-diamine

C10H18N2O6Pt — CID 175900001

IUPAC(2R,3R)-2,3-dihydroxybutanedioate;platinum(2+);trans-(1R,2R)-cyclohexane-1,2-diamine
SMILESN[C@@H]1CCCC[C@H]1N.O=C([O-])[C@H](O)[C@@H](O)C(=O)[O-].[Pt+2]
InChIInChI=1S/C6H14N2.C4H6O6.Pt/c7-5-3-1-2-4-6(5)8;5-1(3(7)8)2(6)4(9)10;/h5-6H,1-4,7-8H2;1-2,5-6H,(H,7,8)(H,9,10);/q;;+2/p-2/t5-,6-;1-,2-;/m11./s1
InChIKeyPKSMSXZOPYFJSL-PBESTUOXSA-L
MW457.34 g/mol
LogP-4.58
Rot. Bonds3

About (2R,3R)-2,3-dihydroxybutanedioate;platinum(2+);trans-(1R,2R)-cyclohexane-1,2-diamine

(2R,3R)-2,3-dihydroxybutanedioate;platinum(2+);trans-(1R,2R)-cyclohexane-1,2-diamine (PubChem CID 175900001) has the molecular formula C10H18N2O6Pt and a molecular weight of 457.34 g/mol. Its IUPAC name is (2R,3R)-2,3-dihydroxybutanedioate;platinum(2+);trans-(1R,2R)-cyclohexane-1,2-diamine.

Molecular Properties

Compound Name(2R,3R)-2,3-dihydroxybutanedioate;platinum(2+);trans-(1R,2R)-cyclohexane-1,2-diamine
PubChem CID175900001
Molecular FormulaC10H18N2O6Pt
Molecular Weight457.34 g/mol
Exact Mass457.08
IUPAC Name(2R,3R)-2,3-dihydroxybutanedioate;platinum(2+);trans-(1R,2R)-cyclohexane-1,2-diamine
SMILESN[C@@H]1CCCC[C@H]1N.O=C([O-])[C@H](O)[C@@H](O)C(=O)[O-].[Pt+2]
InChIInChI=1S/C6H14N2.C4H6O6.Pt/c7-5-3-1-2-4-6(5)8;5-1(3(7)8)2(6)4(9)10;/h5-6H,1-4,7-8H2;1-2,5-6H,(H,7,8)(H,9,10);/q;;+2/p-2/t5-,6-;1-,2-;/m11./s1
InChIKeyPKSMSXZOPYFJSL-PBESTUOXSA-L
XLogP-4.58
TPSA172.76 Ų
H-Bond Donors4
H-Bond Acceptors8
Rotatable Bonds3
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500457.34
LogP ≤ 5-4.58
H-Bond Donors ≤ 54
H-Bond Acceptors ≤ 108

Analyze (2R,3R)-2,3-dihydroxybutanedioate;platinum(2+);trans-(1R,2R)-cyclohexane-1,2-diamine with MolForge

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Related Compounds

cyclohexane-1,2-diamine;bis(1-hydroxypropane-1,2,3-tricarboxylate);tris(platinum(2+))
CID 161329805
oxalic acid;platinum(2+);trans-(1S,2S)-cyclohexane-1,2-diamine
CID 163285607
cyclohexane-1,2-diamine;oxalic acid;platinum(2+)
CID 6394767
bis(cyclohexane-1,2-diamine);oxalate;platinum(4+)
CID 173119560
acetic acid;cyclohexane-1,2-diamine
CID 67321744
acetic acid;trans-(1R,2R)-cyclohexane-1,2-diamine
CID 159991522
2,3-dihydroxybutanedioate
CID 19608871
cyclohexane-1,2-diamine;phosphoric acid
CID 70269724
2,3-dihydroxybutanedioate;manganese(2+)
CID 22027285
dibismuth;tris((2R,3R)-2,3-dihydroxybutanedioate)
CID 3080629
dipotassium;(2R,3S)-2,3-dihydroxybutanedioate
CID 6452017
dioxidanium;platinum(2+);trans-(1R,2R)-cyclohexane-1,2-diamine
CID 59971329

Frequently Asked Questions

What is the IUPAC name of (2R,3R)-2,3-dihydroxybutanedioate;platinum(2+);trans-(1R,2R)-cyclohexane-1,2-diamine?
The IUPAC name of (2R,3R)-2,3-dihydroxybutanedioate;platinum(2+);trans-(1R,2R)-cyclohexane-1,2-diamine (CID 175900001) is (2R,3R)-2,3-dihydroxybutanedioate;platinum(2+);trans-(1R,2R)-cyclohexane-1,2-diamine.
What is the SMILES notation for (2R,3R)-2,3-dihydroxybutanedioate;platinum(2+);trans-(1R,2R)-cyclohexane-1,2-diamine?
The canonical SMILES for (2R,3R)-2,3-dihydroxybutanedioate;platinum(2+);trans-(1R,2R)-cyclohexane-1,2-diamine is N[C@@H]1CCCC[C@H]1N.O=C([O-])[C@H](O)[C@@H](O)C(=O)[O-].[Pt+2].
What is the InChIKey of (2R,3R)-2,3-dihydroxybutanedioate;platinum(2+);trans-(1R,2R)-cyclohexane-1,2-diamine?
The InChIKey is PKSMSXZOPYFJSL-PBESTUOXSA-L. The full InChI is InChI=1S/C6H14N2.C4H6O6.Pt/c7-5-3-1-2-4-6(5)8;5-1(3(7)8)2(6)4(9)10;/h5-6H,1-4,7-8H2;1-2,5-6H,(H,7,8)(H,9,10);/q;;+2/p-2/t5-,6-;1-,2-;/m11./s1.
What are the key properties of (2R,3R)-2,3-dihydroxybutanedioate;platinum(2+);trans-(1R,2R)-cyclohexane-1,2-diamine?
(2R,3R)-2,3-dihydroxybutanedioate;platinum(2+);trans-(1R,2R)-cyclohexane-1,2-diamine has a molecular weight of 457.34 g/mol, XLogP of -4.58, 3 rotatable bonds, 4 hydrogen bond donors, and 8 hydrogen bond acceptors.
Where does this data come from?
All data for (2R,3R)-2,3-dihydroxybutanedioate;platinum(2+);trans-(1R,2R)-cyclohexane-1,2-diamine is sourced from PubChem (CID 175900001), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).