N-carbamoyl-N-(1-hydrazinyl-1-oxopropan-2-yl)-2-hydroxyacetamide

C6H12N4O4 — CID 174509089

IUPACN-carbamoyl-N-(1-hydrazinyl-1-oxopropan-2-yl)-2-hydroxyacetamide
SMILESCC(C(=O)NN)N(C(N)=O)C(=O)CO
InChIInChI=1S/C6H12N4O4/c1-3(5(13)9-8)10(6(7)14)4(12)2-11/h3,11H,2,8H2,1H3,(H2,7,14)(H,9,13)
InChIKeyWQHXHRSRISIGIE-UHFFFAOYSA-N
MW204.19 g/mol
LogP-2.74
Rot. Bonds3

About N-carbamoyl-N-(1-hydrazinyl-1-oxopropan-2-yl)-2-hydroxyacetamide

N-carbamoyl-N-(1-hydrazinyl-1-oxopropan-2-yl)-2-hydroxyacetamide (PubChem CID 174509089) has the molecular formula C6H12N4O4 and a molecular weight of 204.19 g/mol. Its IUPAC name is N-carbamoyl-N-(1-hydrazinyl-1-oxopropan-2-yl)-2-hydroxyacetamide.

Molecular Properties

Compound NameN-carbamoyl-N-(1-hydrazinyl-1-oxopropan-2-yl)-2-hydroxyacetamide
PubChem CID174509089
Molecular FormulaC6H12N4O4
Molecular Weight204.19 g/mol
Exact Mass204.09
IUPAC NameN-carbamoyl-N-(1-hydrazinyl-1-oxopropan-2-yl)-2-hydroxyacetamide
SMILESCC(C(=O)NN)N(C(N)=O)C(=O)CO
InChIInChI=1S/C6H12N4O4/c1-3(5(13)9-8)10(6(7)14)4(12)2-11/h3,11H,2,8H2,1H3,(H2,7,14)(H,9,13)
InChIKeyWQHXHRSRISIGIE-UHFFFAOYSA-N
XLogP-2.74
TPSA138.75 Ų
H-Bond Donors4
H-Bond Acceptors5
Rotatable Bonds3
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500204.19
LogP ≤ 5-2.74
H-Bond Donors ≤ 54
H-Bond Acceptors ≤ 105

Computed Properties (RDKit)

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

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Related Compounds

2-[carbamoyl-(2-hydroxyacetyl)amino]propanoic acid
CID 174602823
N-carbamoyl-2-hydroxy-N-propan-2-ylacetamide
CID 158203403
2-[bis(2-hydroxyacetyl)amino]propanamide
CID 141435220
2-[bis(2-methylpropyl)amino]propanehydrazide
CID 63585398
2-[bis(2-methylpropyl)amino]butanehydrazide
CID 63585587
N-carbamoyl-2-hydroxy-N-methylacetamide
CID 160682561
2-butan-2-ylpropanedihydrazide
CID 15253260
2-[2-hydroxyethyl(2,2,2-trifluoroethyl)amino]propanehydrazide
CID 107493147
2-[(1-hydrazinyl-1-oxopropan-2-yl)-propylamino]-N,N-dimethylacetamide
CID 63578798
4-hydroxy-2-methylbutanehydrazide;hydrochloride
CID 146268568
(2S)-2-(dimethylamino)butanehydrazide
CID 30403559
2-[cyclobutyl(3-hydroxypropyl)amino]propanehydrazide
CID 102873675

Frequently Asked Questions

What is the IUPAC name of N-carbamoyl-N-(1-hydrazinyl-1-oxopropan-2-yl)-2-hydroxyacetamide?
The IUPAC name of N-carbamoyl-N-(1-hydrazinyl-1-oxopropan-2-yl)-2-hydroxyacetamide (CID 174509089) is N-carbamoyl-N-(1-hydrazinyl-1-oxopropan-2-yl)-2-hydroxyacetamide.
What is the SMILES notation for N-carbamoyl-N-(1-hydrazinyl-1-oxopropan-2-yl)-2-hydroxyacetamide?
The canonical SMILES for N-carbamoyl-N-(1-hydrazinyl-1-oxopropan-2-yl)-2-hydroxyacetamide is CC(C(=O)NN)N(C(N)=O)C(=O)CO.
What is the InChIKey of N-carbamoyl-N-(1-hydrazinyl-1-oxopropan-2-yl)-2-hydroxyacetamide?
The InChIKey is WQHXHRSRISIGIE-UHFFFAOYSA-N. The full InChI is InChI=1S/C6H12N4O4/c1-3(5(13)9-8)10(6(7)14)4(12)2-11/h3,11H,2,8H2,1H3,(H2,7,14)(H,9,13).
What are the key properties of N-carbamoyl-N-(1-hydrazinyl-1-oxopropan-2-yl)-2-hydroxyacetamide?
N-carbamoyl-N-(1-hydrazinyl-1-oxopropan-2-yl)-2-hydroxyacetamide has a molecular weight of 204.19 g/mol, XLogP of -2.74, 3 rotatable bonds, 4 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N-carbamoyl-N-(1-hydrazinyl-1-oxopropan-2-yl)-2-hydroxyacetamide is sourced from PubChem (CID 174509089), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).