N-(2-aminoethylidene)acetamide

C4H8N2O — CID 20719069

IUPACN-(2-aminoethylidene)acetamide
SMILESCC(=O)/N=C/CN
InChIInChI=1S/C4H8N2O/c1-4(7)6-3-2-5/h3H,2,5H2,1H3/b6-3+
InChIKeyPJYUDBPZSAEBFA-ZZXKWVIFSA-N
MW100.12 g/mol
LogP-0.44
Rot. Bonds1

About N-(2-aminoethylidene)acetamide

N-(2-aminoethylidene)acetamide (PubChem CID 20719069) has the molecular formula C4H8N2O and a molecular weight of 100.12 g/mol. Its IUPAC name is N-(2-aminoethylidene)acetamide.

Molecular Properties

Compound NameN-(2-aminoethylidene)acetamide
PubChem CID20719069
Molecular FormulaC4H8N2O
Molecular Weight100.12 g/mol
Exact Mass100.06
IUPAC NameN-(2-aminoethylidene)acetamide
SMILESCC(=O)/N=C/CN
InChIInChI=1S/C4H8N2O/c1-4(7)6-3-2-5/h3H,2,5H2,1H3/b6-3+
InChIKeyPJYUDBPZSAEBFA-ZZXKWVIFSA-N
XLogP-0.44
TPSA55.45 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 ≤ 5-0.44
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-(2-aminoethylidene)acetamide?
The IUPAC name of N-(2-aminoethylidene)acetamide (CID 20719069) is N-(2-aminoethylidene)acetamide.
What is the SMILES notation for N-(2-aminoethylidene)acetamide?
The canonical SMILES for N-(2-aminoethylidene)acetamide is CC(=O)/N=C/CN.
What is the InChIKey of N-(2-aminoethylidene)acetamide?
The InChIKey is PJYUDBPZSAEBFA-ZZXKWVIFSA-N. The full InChI is InChI=1S/C4H8N2O/c1-4(7)6-3-2-5/h3H,2,5H2,1H3/b6-3+.
What are the key properties of N-(2-aminoethylidene)acetamide?
N-(2-aminoethylidene)acetamide has a molecular weight of 100.12 g/mol, XLogP of -0.44, 1 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2-aminoethylidene)acetamide is sourced from PubChem (CID 20719069), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).