N,N-di((113C)methyl)acetamide;zinc

C4H8NOZn- — CID 175804648

IUPACN,N-di((113C)methyl)acetamide;zinc
SMILES[CH2-]C(=O)N([13CH3])[13CH3].[Zn]
InChIInChI=1S/C4H8NO.Zn/c1-4(6)5(2)3;/h1H2,2-3H3;/q-1;/i2+1,3+1;
InChIKeyGVTSSHRLNOXJFG-MEFQWSPQSA-N
MW153.49 g/mol
LogP-0.09
Rot. Bonds

About N,N-di((113C)methyl)acetamide;zinc

N,N-di((113C)methyl)acetamide;zinc (PubChem CID 175804648) has the molecular formula C4H8NOZn- and a molecular weight of 153.49 g/mol. Its IUPAC name is N,N-di((113C)methyl)acetamide;zinc.

Molecular Properties

Compound NameN,N-di((113C)methyl)acetamide;zinc
PubChem CID175804648
Molecular FormulaC4H8NOZn-
Molecular Weight153.49 g/mol
Exact Mass152.00
IUPAC NameN,N-di((113C)methyl)acetamide;zinc
SMILES[CH2-]C(=O)N([13CH3])[13CH3].[Zn]
InChIInChI=1S/C4H8NO.Zn/c1-4(6)5(2)3;/h1H2,2-3H3;/q-1;/i2+1,3+1;
InChIKeyGVTSSHRLNOXJFG-MEFQWSPQSA-N
XLogP-0.09
TPSA20.31 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds
Heavy Atoms7
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500153.49
LogP ≤ 5-0.09
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

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

N,N-dimethylacetamide;yttrium
CID 59870405
dimethylcarbamic acid;ethane
CID 143338074
azane;N,N-dimethylacetamide
CID 161145572
dimethylcarbamic acid;nickel
CID 87135907
acetic acid;acetic acid;alumane;zinc
CID 174731596
N,N-dimethylacetamide;molecular iodine
CID 158534416
N,N-dimethylacetamide;formaldehyde
CID 54040691
lithium;N,N-dimethylacetamide;chloride
CID 87129072
CID 22088154
CID 22088154
bis(N,N-dimethylacetamide);hydron;bromide;dihydrobromide
CID 173055527
1,1,3,3-tetramethylurea;urea
CID 158796669
3-(dimethylcarbamoylimino)-1,1-dimethylurea
CID 4278

Frequently Asked Questions

What is the IUPAC name of N,N-di((113C)methyl)acetamide;zinc?
The IUPAC name of N,N-di((113C)methyl)acetamide;zinc (CID 175804648) is N,N-di((113C)methyl)acetamide;zinc.
What is the SMILES notation for N,N-di((113C)methyl)acetamide;zinc?
The canonical SMILES for N,N-di((113C)methyl)acetamide;zinc is [CH2-]C(=O)N([13CH3])[13CH3].[Zn].
What is the InChIKey of N,N-di((113C)methyl)acetamide;zinc?
The InChIKey is GVTSSHRLNOXJFG-MEFQWSPQSA-N. The full InChI is InChI=1S/C4H8NO.Zn/c1-4(6)5(2)3;/h1H2,2-3H3;/q-1;/i2+1,3+1;.
What are the key properties of N,N-di((113C)methyl)acetamide;zinc?
N,N-di((113C)methyl)acetamide;zinc has a molecular weight of 153.49 g/mol, XLogP of -0.09, 0 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for N,N-di((113C)methyl)acetamide;zinc is sourced from PubChem (CID 175804648), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).