dimethylaminomethanone;zinc

C3H6NOZn- — CID 151869749

IUPACdimethylaminomethanone;zinc
SMILESCN(C)[C-]=O.[Zn]
InChIInChI=1S/C3H6NO.Zn/c1-4(2)3-5;/h1-2H3;/q-1;
InChIKeyPXEMDLLGQUNDLH-UHFFFAOYSA-N
MW137.48 g/mol
LogP-0.39
Rot. Bonds1

About dimethylaminomethanone;zinc

dimethylaminomethanone;zinc (PubChem CID 151869749) has the molecular formula C3H6NOZn- and a molecular weight of 137.48 g/mol. Its IUPAC name is dimethylaminomethanone;zinc.

Molecular Properties

Compound Namedimethylaminomethanone;zinc
PubChem CID151869749
Molecular FormulaC3H6NOZn-
Molecular Weight137.48 g/mol
Exact Mass135.97
IUPAC Namedimethylaminomethanone;zinc
SMILESCN(C)[C-]=O.[Zn]
InChIInChI=1S/C3H6NO.Zn/c1-4(2)3-5;/h1-2H3;/q-1;
InChIKeyPXEMDLLGQUNDLH-UHFFFAOYSA-N
XLogP-0.39
TPSA20.31 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds1
Heavy Atoms6
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500137.48
LogP ≤ 5-0.39
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

Computed Properties (RDKit)

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

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Frequently Asked Questions

What is the IUPAC name of dimethylaminomethanone;zinc?
The IUPAC name of dimethylaminomethanone;zinc (CID 151869749) is dimethylaminomethanone;zinc.
What is the SMILES notation for dimethylaminomethanone;zinc?
The canonical SMILES for dimethylaminomethanone;zinc is CN(C)[C-]=O.[Zn].
What is the InChIKey of dimethylaminomethanone;zinc?
The InChIKey is PXEMDLLGQUNDLH-UHFFFAOYSA-N. The full InChI is InChI=1S/C3H6NO.Zn/c1-4(2)3-5;/h1-2H3;/q-1;.
What are the key properties of dimethylaminomethanone;zinc?
dimethylaminomethanone;zinc has a molecular weight of 137.48 g/mol, XLogP of -0.39, 1 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for dimethylaminomethanone;zinc is sourced from PubChem (CID 151869749), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).