N-acetyl-N-hydroxyacetamide;formaldehyde

C5H9NO4 — CID 144940058

IUPACN-acetyl-N-hydroxyacetamide;formaldehyde
SMILESC=O.CC(=O)N(O)C(C)=O
InChIInChI=1S/C4H7NO3.CH2O/c1-3(6)5(8)4(2)7;1-2/h8H,1-2H3;1H2
InChIKeyVSCZGMYPLJZUKQ-UHFFFAOYSA-N
MW147.13 g/mol
LogP-0.41
Rot. Bonds

About N-acetyl-N-hydroxyacetamide;formaldehyde

N-acetyl-N-hydroxyacetamide;formaldehyde (PubChem CID 144940058) has the molecular formula C5H9NO4 and a molecular weight of 147.13 g/mol. Its IUPAC name is N-acetyl-N-hydroxyacetamide;formaldehyde.

Molecular Properties

Compound NameN-acetyl-N-hydroxyacetamide;formaldehyde
PubChem CID144940058
Molecular FormulaC5H9NO4
Molecular Weight147.13 g/mol
Exact Mass147.05
IUPAC NameN-acetyl-N-hydroxyacetamide;formaldehyde
SMILESC=O.CC(=O)N(O)C(C)=O
InChIInChI=1S/C4H7NO3.CH2O/c1-3(6)5(8)4(2)7;1-2/h8H,1-2H3;1H2
InChIKeyVSCZGMYPLJZUKQ-UHFFFAOYSA-N
XLogP-0.41
TPSA74.68 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds
Heavy Atoms10
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500147.13
LogP ≤ 5-0.41
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'hydroxamic_acid', 'substructure': 'N/A'}, {'alert_name': 'Oxygen-nitrogen_single_bond', 'substructure': 'N/A'}

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Related Compounds

N,N-dimethylacetamide;formaldehyde
CID 54040691
acetic acid;formaldehyde;hydrate
CID 19350045
[[2-[acetyl(hydroxy)amino]-2-oxoethyl]amino]methyl-methylphosphinic acid
CID 142100287
CID 59957402
CID 59957402
azane;N,N-dimethylacetamide
CID 161145572
N,N-diacetylacetamide;trihydrochloride
CID 173022405
formaldehyde;2-methylpropane;propan-2-one
CID 157476549
calcium;acetic acid;formaldehyde;hydride
CID 173277282
N-acetyl-N-ethenylacetamide
CID 15657389
lithium;N,N-dimethylacetamide;chloride
CID 87129072
N,N-dimethylacetamide;molecular iodine
CID 158534416
formaldehyde;N-methylacetamide
CID 159490973

Frequently Asked Questions

What is the IUPAC name of N-acetyl-N-hydroxyacetamide;formaldehyde?
The IUPAC name of N-acetyl-N-hydroxyacetamide;formaldehyde (CID 144940058) is N-acetyl-N-hydroxyacetamide;formaldehyde.
What is the SMILES notation for N-acetyl-N-hydroxyacetamide;formaldehyde?
The canonical SMILES for N-acetyl-N-hydroxyacetamide;formaldehyde is C=O.CC(=O)N(O)C(C)=O.
What is the InChIKey of N-acetyl-N-hydroxyacetamide;formaldehyde?
The InChIKey is VSCZGMYPLJZUKQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C4H7NO3.CH2O/c1-3(6)5(8)4(2)7;1-2/h8H,1-2H3;1H2.
What are the key properties of N-acetyl-N-hydroxyacetamide;formaldehyde?
N-acetyl-N-hydroxyacetamide;formaldehyde has a molecular weight of 147.13 g/mol, XLogP of -0.41, 0 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-acetyl-N-hydroxyacetamide;formaldehyde is sourced from PubChem (CID 144940058), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).