(carbamohydrazonoylamino) 2-hydroxyacetate

C3H8N4O3 — CID 91197727

IUPAC(carbamohydrazonoylamino) 2-hydroxyacetate
SMILESNN=C(N)NOC(=O)CO
InChIInChI=1S/C3H8N4O3/c4-3(6-5)7-10-2(9)1-8/h8H,1,5H2,(H3,4,6,7)
InChIKeySZIDPVMFKWBQMN-UHFFFAOYSA-N
MW148.12 g/mol
LogP-2.79
Rot. Bonds1

About (carbamohydrazonoylamino) 2-hydroxyacetate

(carbamohydrazonoylamino) 2-hydroxyacetate (PubChem CID 91197727) has the molecular formula C3H8N4O3 and a molecular weight of 148.12 g/mol. Its IUPAC name is (carbamohydrazonoylamino) 2-hydroxyacetate.

Molecular Properties

Compound Name(carbamohydrazonoylamino) 2-hydroxyacetate
PubChem CID91197727
Molecular FormulaC3H8N4O3
Molecular Weight148.12 g/mol
Exact Mass148.06
IUPAC Name(carbamohydrazonoylamino) 2-hydroxyacetate
SMILESNN=C(N)NOC(=O)CO
InChIInChI=1S/C3H8N4O3/c4-3(6-5)7-10-2(9)1-8/h8H,1,5H2,(H3,4,6,7)
InChIKeySZIDPVMFKWBQMN-UHFFFAOYSA-N
XLogP-2.79
TPSA122.96 Ų
H-Bond Donors4
H-Bond Acceptors5
Rotatable Bonds1
Heavy Atoms10
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500148.12
LogP ≤ 5-2.79
H-Bond Donors ≤ 54
H-Bond Acceptors ≤ 105

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'hydrazine', 'substructure': 'N/A'}, {'alert_name': 'imine_1', 'substructure': 'N/A'}, {'alert_name': 'imine_2', 'substructure': 'N/A'}, {'alert_name': 'Oxygen-nitrogen_single_bond', 'substructure': 'N/A'}

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Related Compounds

[(2-hydroxyacetyl)oxyamino]azanium
CID 20617652
2-amino-1-(2-hydroxyethoxy)guanidine
CID 154403100
(2-hydroxyacetyl)oxymethyl 2-hydroxyacetate;methane
CID 161332645
2-amino-1-propoxyguanidine
CID 130609787
carbamohydrazonoyl 2-hydrazinylacetate
CID 173301303
ethane-1,2-diol;2-(2-hydroxyacetyl)oxyethyl 2-hydroxyacetate;methane
CID 163645846
phosphono 2-hydroxyacetate
CID 22320969
2-aminoguanidine;urea
CID 87270498
guanidine;2-hydroxyacetic acid;hydrochloride
CID 175041207
guanidine;hydrazinecarboxylic acid
CID 162000755
stibanyl 2-hydroxyacetate
CID 174289017
silyl 2-hydroxyacetate
CID 123398347

Frequently Asked Questions

What is the IUPAC name of (carbamohydrazonoylamino) 2-hydroxyacetate?
The IUPAC name of (carbamohydrazonoylamino) 2-hydroxyacetate (CID 91197727) is (carbamohydrazonoylamino) 2-hydroxyacetate.
What is the SMILES notation for (carbamohydrazonoylamino) 2-hydroxyacetate?
The canonical SMILES for (carbamohydrazonoylamino) 2-hydroxyacetate is NN=C(N)NOC(=O)CO.
What is the InChIKey of (carbamohydrazonoylamino) 2-hydroxyacetate?
The InChIKey is SZIDPVMFKWBQMN-UHFFFAOYSA-N. The full InChI is InChI=1S/C3H8N4O3/c4-3(6-5)7-10-2(9)1-8/h8H,1,5H2,(H3,4,6,7).
What are the key properties of (carbamohydrazonoylamino) 2-hydroxyacetate?
(carbamohydrazonoylamino) 2-hydroxyacetate has a molecular weight of 148.12 g/mol, XLogP of -2.79, 1 rotatable bonds, 4 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for (carbamohydrazonoylamino) 2-hydroxyacetate is sourced from PubChem (CID 91197727), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).