N-ethyl-N',N'-bis(hydroxyamino)oxamide

C4H10N4O4 — CID 174658040

IUPACN-ethyl-N',N'-bis(hydroxyamino)oxamide
SMILESCCNC(=O)C(=O)N(NO)NO
InChIInChI=1S/C4H10N4O4/c1-2-5-3(9)4(10)8(6-11)7-12/h6-7,11-12H,2H2,1H3,(H,5,9)
InChIKeyJGHYWUKHCDBKHA-UHFFFAOYSA-N
MW178.15 g/mol
LogP-2.26
Rot. Bonds3

About N-ethyl-N',N'-bis(hydroxyamino)oxamide

N-ethyl-N',N'-bis(hydroxyamino)oxamide (PubChem CID 174658040) has the molecular formula C4H10N4O4 and a molecular weight of 178.15 g/mol. Its IUPAC name is N-ethyl-N',N'-bis(hydroxyamino)oxamide.

Molecular Properties

Compound NameN-ethyl-N',N'-bis(hydroxyamino)oxamide
PubChem CID174658040
Molecular FormulaC4H10N4O4
Molecular Weight178.15 g/mol
Exact Mass178.07
IUPAC NameN-ethyl-N',N'-bis(hydroxyamino)oxamide
SMILESCCNC(=O)C(=O)N(NO)NO
InChIInChI=1S/C4H10N4O4/c1-2-5-3(9)4(10)8(6-11)7-12/h6-7,11-12H,2H2,1H3,(H,5,9)
InChIKeyJGHYWUKHCDBKHA-UHFFFAOYSA-N
XLogP-2.26
TPSA113.93 Ų
H-Bond Donors5
H-Bond Acceptors6
Rotatable Bonds3
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500178.15
LogP ≤ 5-2.26
H-Bond Donors ≤ 55
H-Bond Acceptors ≤ 106

Computed Properties (RDKit)

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

Analyze N-ethyl-N',N'-bis(hydroxyamino)oxamide with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

N'-butyl-N-ethyl-N'-propyloxamide
CID 108521406
N-ethyl-2,3,3-trihydroxyprop-2-enamide
CID 161274596
2-(ethylamino)-2-oxoacetic acid;hydrochloride
CID 87148402
N-(ethylcarbamoyl)-N-propylbutanamide
CID 91362327
N-ethyl-2-fluoroprop-2-enamide
CID 138502811
(E)-N-ethyl-2-methylbut-2-enamide
CID 22451134
N,N'-diethylpropanediamide
CID 4600245
1,3-diethylurea;ethane
CID 142885504
N'-[3-(dimethylamino)propyl]-N-ethyloxamide
CID 45000040
(2E)-2-(dimethylaminomethylidene)-N-ethyl-3-oxobutanamide
CID 23564114
CID 88764909
CID 88764909
ethylcarbamic acid;yttrium
CID 147921444

Frequently Asked Questions

What is the IUPAC name of N-ethyl-N',N'-bis(hydroxyamino)oxamide?
The IUPAC name of N-ethyl-N',N'-bis(hydroxyamino)oxamide (CID 174658040) is N-ethyl-N',N'-bis(hydroxyamino)oxamide.
What is the SMILES notation for N-ethyl-N',N'-bis(hydroxyamino)oxamide?
The canonical SMILES for N-ethyl-N',N'-bis(hydroxyamino)oxamide is CCNC(=O)C(=O)N(NO)NO.
What is the InChIKey of N-ethyl-N',N'-bis(hydroxyamino)oxamide?
The InChIKey is JGHYWUKHCDBKHA-UHFFFAOYSA-N. The full InChI is InChI=1S/C4H10N4O4/c1-2-5-3(9)4(10)8(6-11)7-12/h6-7,11-12H,2H2,1H3,(H,5,9).
What are the key properties of N-ethyl-N',N'-bis(hydroxyamino)oxamide?
N-ethyl-N',N'-bis(hydroxyamino)oxamide has a molecular weight of 178.15 g/mol, XLogP of -2.26, 3 rotatable bonds, 5 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for N-ethyl-N',N'-bis(hydroxyamino)oxamide is sourced from PubChem (CID 174658040), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).