2-methanidyloxyacetic acid;2-methanidyloxy-N,N-bis(3-trimethoxysilylpropyl)acetamide;bis(rutherfordium)

C18H39NO11Rf2Si2-2 — CID 157219113

IUPAC2-methanidyloxyacetic acid;2-methanidyloxy-N,N-bis(3-trimethoxysilylpropyl)acetamide;bis(rutherfordium)
SMILES[CH2-]OCC(=O)N(CCC[Si](OC)(OC)OC)CCC[Si](OC)(OC)OC.[CH2-]OCC(=O)O.[Rf].[Rf]
InChIInChI=1S/C15H34NO8Si2.C3H5O3.2Rf/c1-18-14-15(17)16(10-8-12-25(19-2,20-3)21-4)11-9-13-26(22-5,23-6)24-7;1-6-2-3(4)5;;/h1,8-14H2,2-7H3;1-2H2,(H,4,5);;/q2*-1;;
InChIKeyPYBLIVHARZTHRP-UHFFFAOYSA-N
MW1035.68 g/mol
LogP1.04
Rot. Bonds18

About 2-methanidyloxyacetic acid;2-methanidyloxy-N,N-bis(3-trimethoxysilylpropyl)acetamide;bis(rutherfordium)

2-methanidyloxyacetic acid;2-methanidyloxy-N,N-bis(3-trimethoxysilylpropyl)acetamide;bis(rutherfordium) (PubChem CID 157219113) has the molecular formula C18H39NO11Rf2Si2-2 and a molecular weight of 1035.68 g/mol. Its IUPAC name is 2-methanidyloxyacetic acid;2-methanidyloxy-N,N-bis(3-trimethoxysilylpropyl)acetamide;bis(rutherfordium).

Molecular Properties

Compound Name2-methanidyloxyacetic acid;2-methanidyloxy-N,N-bis(3-trimethoxysilylpropyl)acetamide;bis(rutherfordium)
PubChem CID157219113
Molecular FormulaC18H39NO11Rf2Si2-2
Molecular Weight1035.68 g/mol
Exact Mass1035.45
IUPAC Name2-methanidyloxyacetic acid;2-methanidyloxy-N,N-bis(3-trimethoxysilylpropyl)acetamide;bis(rutherfordium)
SMILES[CH2-]OCC(=O)N(CCC[Si](OC)(OC)OC)CCC[Si](OC)(OC)OC.[CH2-]OCC(=O)O.[Rf].[Rf]
InChIInChI=1S/C15H34NO8Si2.C3H5O3.2Rf/c1-18-14-15(17)16(10-8-12-25(19-2,20-3)21-4)11-9-13-26(22-5,23-6)24-7;1-6-2-3(4)5;;/h1,8-14H2,2-7H3;1-2H2,(H,4,5);;/q2*-1;;
InChIKeyPYBLIVHARZTHRP-UHFFFAOYSA-N
XLogP1.04
TPSA131.45 Ų
H-Bond Donors1
H-Bond Acceptors10
Rotatable Bonds18
Heavy Atoms34
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 5001035.68
LogP ≤ 51.04
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 1010

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Carbo_cation/anion', 'substructure': 'N/A'}, {'alert_name': 'heavy_metal', 'substructure': 'N/A'}

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Related Compounds

2-bromo-N,N-bis(3-trimethoxysilylpropyl)acetamide
CID 168863060
N-methanidyl-3-trimethoxysilyl-N-(3-trimethoxysilylpropyl)propanamide;rutherfordium
CID 162464001
3,4,4-trifluoro-N,N-bis(3-trimethoxysilylpropyl)butanamide
CID 176815905
CID 131883983
CID 131883983
methyl(3-trimethoxysilylpropyl)carbamic acid
CID 71432003
2-hydroxy-N,N-bis(3-trimethoxysilylpropyl)propanamide
CID 140720922
2-[2-[3-[dimethoxy(methyl)silyl]propyl-propylamino]-2-oxoethoxy]-N,N-dipropylacetamide
CID 158252099
N-methyl-N-(3-trimethoxysilylpropyl)propanamide
CID 87495957
2-[2-aminoethyl(3-trimethoxysilylpropyl)amino]acetic acid
CID 59561248
N-methanidyl-4-trimethoxysilyl-N-(4-trimethoxysilylbutyl)butanamide;rutherfordium
CID 162463989
trisodium;N-carboxylato-N-[2-[carboxylato(3-trimethoxysilylpropyl)amino]ethyl]carbamate
CID 90475505
3-[propyl(3-trimethoxysilylpropyl)amino]propanoic acid
CID 151472451

Frequently Asked Questions

What is the IUPAC name of 2-methanidyloxyacetic acid;2-methanidyloxy-N,N-bis(3-trimethoxysilylpropyl)acetamide;bis(rutherfordium)?
The IUPAC name of 2-methanidyloxyacetic acid;2-methanidyloxy-N,N-bis(3-trimethoxysilylpropyl)acetamide;bis(rutherfordium) (CID 157219113) is 2-methanidyloxyacetic acid;2-methanidyloxy-N,N-bis(3-trimethoxysilylpropyl)acetamide;bis(rutherfordium).
What is the SMILES notation for 2-methanidyloxyacetic acid;2-methanidyloxy-N,N-bis(3-trimethoxysilylpropyl)acetamide;bis(rutherfordium)?
The canonical SMILES for 2-methanidyloxyacetic acid;2-methanidyloxy-N,N-bis(3-trimethoxysilylpropyl)acetamide;bis(rutherfordium) is [CH2-]OCC(=O)N(CCC[Si](OC)(OC)OC)CCC[Si](OC)(OC)OC.[CH2-]OCC(=O)O.[Rf].[Rf].
What is the InChIKey of 2-methanidyloxyacetic acid;2-methanidyloxy-N,N-bis(3-trimethoxysilylpropyl)acetamide;bis(rutherfordium)?
The InChIKey is PYBLIVHARZTHRP-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H34NO8Si2.C3H5O3.2Rf/c1-18-14-15(17)16(10-8-12-25(19-2,20-3)21-4)11-9-13-26(22-5,23-6)24-7;1-6-2-3(4)5;;/h1,8-14H2,2-7H3;1-2H2,(H,4,5);;/q2*-1;;.
What are the key properties of 2-methanidyloxyacetic acid;2-methanidyloxy-N,N-bis(3-trimethoxysilylpropyl)acetamide;bis(rutherfordium)?
2-methanidyloxyacetic acid;2-methanidyloxy-N,N-bis(3-trimethoxysilylpropyl)acetamide;bis(rutherfordium) has a molecular weight of 1035.68 g/mol, XLogP of 1.04, 18 rotatable bonds, 1 hydrogen bond donors, and 10 hydrogen bond acceptors.
Where does this data come from?
All data for 2-methanidyloxyacetic acid;2-methanidyloxy-N,N-bis(3-trimethoxysilylpropyl)acetamide;bis(rutherfordium) is sourced from PubChem (CID 157219113), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).