N-methyl-2-methyliminoacetamide

C4H8N2O — CID 55287630

IUPACN-methyl-2-methyliminoacetamide
SMILESC/N=C/C(=O)NC
InChIInChI=1S/C4H8N2O/c1-5-3-4(7)6-2/h3H,1-2H3,(H,6,7)/b5-3+
InChIKeyHVFJUOCQWFZXMU-HWKANZROSA-N
MW100.12 g/mol
LogP-0.57
Rot. Bonds1

About N-methyl-2-methyliminoacetamide

N-methyl-2-methyliminoacetamide (PubChem CID 55287630) has the molecular formula C4H8N2O and a molecular weight of 100.12 g/mol. Its IUPAC name is N-methyl-2-methyliminoacetamide.

Molecular Properties

Compound NameN-methyl-2-methyliminoacetamide
PubChem CID55287630
Molecular FormulaC4H8N2O
Molecular Weight100.12 g/mol
Exact Mass100.06
IUPAC NameN-methyl-2-methyliminoacetamide
SMILESC/N=C/C(=O)NC
InChIInChI=1S/C4H8N2O/c1-5-3-4(7)6-2/h3H,1-2H3,(H,6,7)/b5-3+
InChIKeyHVFJUOCQWFZXMU-HWKANZROSA-N
XLogP-0.57
TPSA41.46 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds1
Heavy Atoms7
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500100.12
LogP ≤ 5-0.57
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'imine_1', 'substructure': 'N/A'}

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Frequently Asked Questions

What is the IUPAC name of N-methyl-2-methyliminoacetamide?
The IUPAC name of N-methyl-2-methyliminoacetamide (CID 55287630) is N-methyl-2-methyliminoacetamide.
What is the SMILES notation for N-methyl-2-methyliminoacetamide?
The canonical SMILES for N-methyl-2-methyliminoacetamide is C/N=C/C(=O)NC.
What is the InChIKey of N-methyl-2-methyliminoacetamide?
The InChIKey is HVFJUOCQWFZXMU-HWKANZROSA-N. The full InChI is InChI=1S/C4H8N2O/c1-5-3-4(7)6-2/h3H,1-2H3,(H,6,7)/b5-3+.
What are the key properties of N-methyl-2-methyliminoacetamide?
N-methyl-2-methyliminoacetamide has a molecular weight of 100.12 g/mol, XLogP of -0.57, 1 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-methyl-2-methyliminoacetamide is sourced from PubChem (CID 55287630), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).