tetrakis(amino-[(2R)-2-amino-4-methylpentanoyl]oxyphosphinate);tin(4+)

C24H56N8O16P4Sn — CID 175759936

IUPACtetrakis(amino-[(2R)-2-amino-4-methylpentanoyl]oxyphosphinate);tin(4+)
SMILESCC(C)C[C@@H](N)C(=O)OP(N)(=O)[O-].CC(C)C[C@@H](N)C(=O)OP(N)(=O)[O-].CC(C)C[C@@H](N)C(=O)OP(N)(=O)[O-].CC(C)C[C@@H](N)C(=O)OP(N)(=O)[O-].[Sn+4]
InChIInChI=1S/4C6H15N2O4P.Sn/c4*1-4(2)3-5(7)6(9)12-13(8,10)11;/h4*4-5H,3,7H2,1-2H3,(H3,8,10,11);/q;;;;+4/p-4/t4*5-;/m1111./s1
InChIKeyUXULMWXNQHAVGE-PNBBQSGBSA-J
MW955.36 g/mol
LogP-3.06
Rot. Bonds16

About tetrakis(amino-[(2R)-2-amino-4-methylpentanoyl]oxyphosphinate);tin(4+)

tetrakis(amino-[(2R)-2-amino-4-methylpentanoyl]oxyphosphinate);tin(4+) (PubChem CID 175759936) has the molecular formula C24H56N8O16P4Sn and a molecular weight of 955.36 g/mol. Its IUPAC name is tetrakis(amino-[(2R)-2-amino-4-methylpentanoyl]oxyphosphinate);tin(4+).

Molecular Properties

Compound Nametetrakis(amino-[(2R)-2-amino-4-methylpentanoyl]oxyphosphinate);tin(4+)
PubChem CID175759936
Molecular FormulaC24H56N8O16P4Sn
Molecular Weight955.36 g/mol
Exact Mass956.18
IUPAC Nametetrakis(amino-[(2R)-2-amino-4-methylpentanoyl]oxyphosphinate);tin(4+)
SMILESCC(C)C[C@@H](N)C(=O)OP(N)(=O)[O-].CC(C)C[C@@H](N)C(=O)OP(N)(=O)[O-].CC(C)C[C@@H](N)C(=O)OP(N)(=O)[O-].CC(C)C[C@@H](N)C(=O)OP(N)(=O)[O-].[Sn+4]
InChIInChI=1S/4C6H15N2O4P.Sn/c4*1-4(2)3-5(7)6(9)12-13(8,10)11;/h4*4-5H,3,7H2,1-2H3,(H3,8,10,11);/q;;;;+4/p-4/t4*5-;/m1111./s1
InChIKeyUXULMWXNQHAVGE-PNBBQSGBSA-J
XLogP-3.06
TPSA473.88 Ų
H-Bond Donors8
H-Bond Acceptors20
Rotatable Bonds16
Heavy Atoms53
Complexity—

Lipinski Rule of Five

3 violations

RuleValue
MW ≤ 500955.36
LogP ≤ 5-3.06
H-Bond Donors ≤ 58
H-Bond Acceptors ≤ 1020

Computed Properties (RDKit)

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

Analyze tetrakis(amino-[(2R)-2-amino-4-methylpentanoyl]oxyphosphinate);tin(4+) with MolForge

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Related Compounds

methyl 2-amino-4-methylpentanoate;phosphoric acid
CID 175229624
4-methylpentan-2-yl 2-amino-4-methylpentanoate
CID 61277406
2-amino-4-methylpentanoate
CID 157437742
ethyl (2S)-2-amino-4-methylpentanoate;hydrochloride
CID 11658447
[(2S)-2-amino-4-methylpentanoyl]oxysulfanyl (2S)-2-amino-4-methylpentanoate
CID 90745956
(4S,7S)-4,7-diamino-2,9-dimethyldecane-5,6-dione
CID 57076326
(2S)-2-amino-4-methylpentanoate;iron(3+)
CID 172736256
(2-amino-2-oxoethyl) (2S)-2-amino-4-methylpentanoate
CID 159439420
CID 164753988
CID 164753988
(2S)-2-(15N)azanyl-4-methyl(213C)pentanoic acid
CID 71309151
ethenyl (2S)-2-amino-4-methylpentanoate
CID 57471579
2-amino-4-methylpentanoic acid;chromium
CID 88640601

Frequently Asked Questions

What is the IUPAC name of tetrakis(amino-[(2R)-2-amino-4-methylpentanoyl]oxyphosphinate);tin(4+)?
The IUPAC name of tetrakis(amino-[(2R)-2-amino-4-methylpentanoyl]oxyphosphinate);tin(4+) (CID 175759936) is tetrakis(amino-[(2R)-2-amino-4-methylpentanoyl]oxyphosphinate);tin(4+).
What is the SMILES notation for tetrakis(amino-[(2R)-2-amino-4-methylpentanoyl]oxyphosphinate);tin(4+)?
The canonical SMILES for tetrakis(amino-[(2R)-2-amino-4-methylpentanoyl]oxyphosphinate);tin(4+) is CC(C)C[C@@H](N)C(=O)OP(N)(=O)[O-].CC(C)C[C@@H](N)C(=O)OP(N)(=O)[O-].CC(C)C[C@@H](N)C(=O)OP(N)(=O)[O-].CC(C)C[C@@H](N)C(=O)OP(N)(=O)[O-].[Sn+4].
What is the InChIKey of tetrakis(amino-[(2R)-2-amino-4-methylpentanoyl]oxyphosphinate);tin(4+)?
The InChIKey is UXULMWXNQHAVGE-PNBBQSGBSA-J. The full InChI is InChI=1S/4C6H15N2O4P.Sn/c4*1-4(2)3-5(7)6(9)12-13(8,10)11;/h4*4-5H,3,7H2,1-2H3,(H3,8,10,11);/q;;;;+4/p-4/t4*5-;/m1111./s1.
What are the key properties of tetrakis(amino-[(2R)-2-amino-4-methylpentanoyl]oxyphosphinate);tin(4+)?
tetrakis(amino-[(2R)-2-amino-4-methylpentanoyl]oxyphosphinate);tin(4+) has a molecular weight of 955.36 g/mol, XLogP of -3.06, 16 rotatable bonds, 8 hydrogen bond donors, and 20 hydrogen bond acceptors.
Where does this data come from?
All data for tetrakis(amino-[(2R)-2-amino-4-methylpentanoyl]oxyphosphinate);tin(4+) is sourced from PubChem (CID 175759936), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).