N-(2-amino-2-oxoethyl)-N-ethyl-2-hydrazinyl-2-oxoacetamide

C6H12N4O3 — CID 103103739

IUPACN-(2-amino-2-oxoethyl)-N-ethyl-2-hydrazinyl-2-oxoacetamide
SMILESCCN(CC(N)=O)C(=O)C(=O)NN
InChIInChI=1S/C6H12N4O3/c1-2-10(3-4(7)11)6(13)5(12)9-8/h2-3,8H2,1H3,(H2,7,11)(H,9,12)
InChIKeyHOHKGBHRCACOQE-UHFFFAOYSA-N
MW188.19 g/mol
LogP-2.69
Rot. Bonds3

About N-(2-amino-2-oxoethyl)-N-ethyl-2-hydrazinyl-2-oxoacetamide

N-(2-amino-2-oxoethyl)-N-ethyl-2-hydrazinyl-2-oxoacetamide (PubChem CID 103103739) has the molecular formula C6H12N4O3 and a molecular weight of 188.19 g/mol. Its IUPAC name is N-(2-amino-2-oxoethyl)-N-ethyl-2-hydrazinyl-2-oxoacetamide.

Molecular Properties

Compound NameN-(2-amino-2-oxoethyl)-N-ethyl-2-hydrazinyl-2-oxoacetamide
PubChem CID103103739
Molecular FormulaC6H12N4O3
Molecular Weight188.19 g/mol
Exact Mass188.09
IUPAC NameN-(2-amino-2-oxoethyl)-N-ethyl-2-hydrazinyl-2-oxoacetamide
SMILESCCN(CC(N)=O)C(=O)C(=O)NN
InChIInChI=1S/C6H12N4O3/c1-2-10(3-4(7)11)6(13)5(12)9-8/h2-3,8H2,1H3,(H2,7,11)(H,9,12)
InChIKeyHOHKGBHRCACOQE-UHFFFAOYSA-N
XLogP-2.69
TPSA118.52 Ų
H-Bond Donors3
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500188.19
LogP ≤ 5-2.69
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

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

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Related Compounds

N-ethyl-2-hydrazinyl-N-[2-(methylamino)-2-oxoethyl]-2-oxoacetamide
CID 61450123
methyl N-(2-amino-2-oxoethyl)-N-ethylcarbamate
CID 103101669
ethyl N-(2-amino-2-oxoethyl)-N-ethylcarbamate
CID 103104222
2-[bis(2-amino-2-oxoethyl)carbamoyl-ethylamino]acetic acid
CID 62923700
3-amino-N-(2-amino-2-oxoethyl)-N-ethyl-2-methylbutanamide
CID 103102016
2-hydrazinyl-N,N-bis(2-methoxyethyl)-2-oxoacetamide
CID 61418318
2-[ethyl-(2-methoxyacetyl)amino]acetamide
CID 103104209
3-amino-N-(2-amino-2-oxoethyl)-N-ethyl-3-methylbutanamide
CID 103102003
N-(2-amino-2-oxoethyl)-N-ethyl-4-hydroxybutanamide
CID 103104212
6-[(2-amino-2-oxoethyl)-ethylamino]-6-oxohexanoic acid
CID 103101524
N-(2-amino-2-oxoethyl)-3-chloro-N-ethyl-2,2-dimethylpropanamide
CID 103101636
3-[[(2-amino-2-oxoethyl)-ethylcarbamoyl]amino]-2-methylpropanoic acid
CID 103103591

Frequently Asked Questions

What is the IUPAC name of N-(2-amino-2-oxoethyl)-N-ethyl-2-hydrazinyl-2-oxoacetamide?
The IUPAC name of N-(2-amino-2-oxoethyl)-N-ethyl-2-hydrazinyl-2-oxoacetamide (CID 103103739) is N-(2-amino-2-oxoethyl)-N-ethyl-2-hydrazinyl-2-oxoacetamide.
What is the SMILES notation for N-(2-amino-2-oxoethyl)-N-ethyl-2-hydrazinyl-2-oxoacetamide?
The canonical SMILES for N-(2-amino-2-oxoethyl)-N-ethyl-2-hydrazinyl-2-oxoacetamide is CCN(CC(N)=O)C(=O)C(=O)NN.
What is the InChIKey of N-(2-amino-2-oxoethyl)-N-ethyl-2-hydrazinyl-2-oxoacetamide?
The InChIKey is HOHKGBHRCACOQE-UHFFFAOYSA-N. The full InChI is InChI=1S/C6H12N4O3/c1-2-10(3-4(7)11)6(13)5(12)9-8/h2-3,8H2,1H3,(H2,7,11)(H,9,12).
What are the key properties of N-(2-amino-2-oxoethyl)-N-ethyl-2-hydrazinyl-2-oxoacetamide?
N-(2-amino-2-oxoethyl)-N-ethyl-2-hydrazinyl-2-oxoacetamide has a molecular weight of 188.19 g/mol, XLogP of -2.69, 3 rotatable bonds, 3 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2-amino-2-oxoethyl)-N-ethyl-2-hydrazinyl-2-oxoacetamide is sourced from PubChem (CID 103103739), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).