methanamine;N-methylacetamide;molecular iodine;propan-2-one;vanadium

C7H18I2N2O2V — CID 160843944

IUPACmethanamine;N-methylacetamide;molecular iodine;propan-2-one;vanadium
SMILESCC(C)=O.CN.CNC(C)=O.II.[V]
InChIInChI=1S/C3H7NO.C3H6O.CH5N.I2.V/c1-3(5)4-2;1-3(2)4;2*1-2;/h1-2H3,(H,4,5);1-2H3;2H2,1H3;;
InChIKeySIJWKOXVICCAKT-UHFFFAOYSA-N
MW466.99 g/mol
LogP1.69
Rot. Bonds

About methanamine;N-methylacetamide;molecular iodine;propan-2-one;vanadium

methanamine;N-methylacetamide;molecular iodine;propan-2-one;vanadium (PubChem CID 160843944) has the molecular formula C7H18I2N2O2V and a molecular weight of 466.99 g/mol. Its IUPAC name is methanamine;N-methylacetamide;molecular iodine;propan-2-one;vanadium.

Molecular Properties

Compound Namemethanamine;N-methylacetamide;molecular iodine;propan-2-one;vanadium
PubChem CID160843944
Molecular FormulaC7H18I2N2O2V
Molecular Weight466.99 g/mol
Exact Mass466.89
IUPAC Namemethanamine;N-methylacetamide;molecular iodine;propan-2-one;vanadium
SMILESCC(C)=O.CN.CNC(C)=O.II.[V]
InChIInChI=1S/C3H7NO.C3H6O.CH5N.I2.V/c1-3(5)4-2;1-3(2)4;2*1-2;/h1-2H3,(H,4,5);1-2H3;2H2,1H3;;
InChIKeySIJWKOXVICCAKT-UHFFFAOYSA-N
XLogP1.69
TPSA72.19 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500466.99
LogP ≤ 51.69
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

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

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Related Compounds

methanamine;bis(N-methylacetamide);propan-2-one
CID 157204854
bis(N-methylacetamide);propan-2-one
CID 158104043
methane;N-methylacetamide
CID 169425645
CID 159040973
CID 159040973
ethane;methane;N-methylacetamide
CID 159401147
potassium;hydride;N-methylacetamide
CID 173418413
formaldehyde;N-methylacetamide
CID 159490973
N-methylacetamide;pentane-2,4-dione;bis(propan-2-one)
CID 91069648
N-methylacetamide;propan-2-ylazanium
CID 158450921
bis(N-methylacetamide);propan-2-amine;propan-2-ylazanium
CID 169429342
methylhydrazine;propan-2-one
CID 87351766
N-methylacetamide;phosphoric acid
CID 174660683

Frequently Asked Questions

What is the IUPAC name of methanamine;N-methylacetamide;molecular iodine;propan-2-one;vanadium?
The IUPAC name of methanamine;N-methylacetamide;molecular iodine;propan-2-one;vanadium (CID 160843944) is methanamine;N-methylacetamide;molecular iodine;propan-2-one;vanadium.
What is the SMILES notation for methanamine;N-methylacetamide;molecular iodine;propan-2-one;vanadium?
The canonical SMILES for methanamine;N-methylacetamide;molecular iodine;propan-2-one;vanadium is CC(C)=O.CN.CNC(C)=O.II.[V].
What is the InChIKey of methanamine;N-methylacetamide;molecular iodine;propan-2-one;vanadium?
The InChIKey is SIJWKOXVICCAKT-UHFFFAOYSA-N. The full InChI is InChI=1S/C3H7NO.C3H6O.CH5N.I2.V/c1-3(5)4-2;1-3(2)4;2*1-2;/h1-2H3,(H,4,5);1-2H3;2H2,1H3;;.
What are the key properties of methanamine;N-methylacetamide;molecular iodine;propan-2-one;vanadium?
methanamine;N-methylacetamide;molecular iodine;propan-2-one;vanadium has a molecular weight of 466.99 g/mol, XLogP of 1.69, 0 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for methanamine;N-methylacetamide;molecular iodine;propan-2-one;vanadium is sourced from PubChem (CID 160843944), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).