[(2R)-1-hydrazinyl-1-oxopropan-2-yl]carbamic acid

C4H9N3O3 — CID 90311881

IUPAC[(2R)-1-hydrazinyl-1-oxopropan-2-yl]carbamic acid
SMILESC[C@@H](NC(=O)O)C(=O)NN
InChIInChI=1S/C4H9N3O3/c1-2(3(8)7-5)6-4(9)10/h2,6H,5H2,1H3,(H,7,8)(H,9,10)/t2-/m1/s1
InChIKeyQNLVZXDFMZCDMS-UWTATZPHSA-N
MW147.13 g/mol
LogP-1.37
Rot. Bonds2

About [(2R)-1-hydrazinyl-1-oxopropan-2-yl]carbamic acid

[(2R)-1-hydrazinyl-1-oxopropan-2-yl]carbamic acid (PubChem CID 90311881) has the molecular formula C4H9N3O3 and a molecular weight of 147.13 g/mol. Its IUPAC name is [(2R)-1-hydrazinyl-1-oxopropan-2-yl]carbamic acid.

Molecular Properties

Compound Name[(2R)-1-hydrazinyl-1-oxopropan-2-yl]carbamic acid
PubChem CID90311881
Molecular FormulaC4H9N3O3
Molecular Weight147.13 g/mol
Exact Mass147.06
IUPAC Name[(2R)-1-hydrazinyl-1-oxopropan-2-yl]carbamic acid
SMILESC[C@@H](NC(=O)O)C(=O)NN
InChIInChI=1S/C4H9N3O3/c1-2(3(8)7-5)6-4(9)10/h2,6H,5H2,1H3,(H,7,8)(H,9,10)/t2-/m1/s1
InChIKeyQNLVZXDFMZCDMS-UWTATZPHSA-N
XLogP-1.37
TPSA104.45 Ų
H-Bond Donors4
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms10
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500147.13
LogP ≤ 5-1.37
H-Bond Donors ≤ 54
H-Bond Acceptors ≤ 103

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

N-[(2S)-1-hydrazinyl-1-oxopropan-2-yl]propanamide
CID 10464584
[(2R)-1-amino-1-oxopropan-2-yl]carbamic acid
CID 66814352
N-[(2R)-1-hydrazinyl-1-oxopropan-2-yl]benzamide
CID 673653
2-methyl-3-sulfanylbutanehydrazide
CID 79415259
[1-(2-fluoroethylamino)-1-oxopropan-2-yl]carbamic acid
CID 90216384
(1-ethoxy-1-oxopropan-2-yl)carbamic acid
CID 58928687
(2S)-2-cyclobutyl-N-[(2S)-1-hydrazinyl-1-oxopropan-2-yl]-2-hydroxyacetamide
CID 134235288
(1-hydrazinyl-3-hydroxy-1-oxopropan-2-yl)carbamic acid
CID 146303988
[(2S)-1-(3,3-dimethylbutylamino)-1-oxopropan-2-yl]carbamic acid
CID 142903182
[1-oxo-1-[2-(2,2,2-trifluoroacetyl)hydrazinyl]propan-2-yl]carbamic acid
CID 90425869
N-[(2R)-1-hydrazinyl-1-oxopropan-2-yl]adamantane-1-carboxamide
CID 7090487
[1-[(2-methylpropan-2-yl)oxy]-1-oxopropan-2-yl]carbamic acid
CID 140986118

Frequently Asked Questions

What is the IUPAC name of [(2R)-1-hydrazinyl-1-oxopropan-2-yl]carbamic acid?
The IUPAC name of [(2R)-1-hydrazinyl-1-oxopropan-2-yl]carbamic acid (CID 90311881) is [(2R)-1-hydrazinyl-1-oxopropan-2-yl]carbamic acid.
What is the SMILES notation for [(2R)-1-hydrazinyl-1-oxopropan-2-yl]carbamic acid?
The canonical SMILES for [(2R)-1-hydrazinyl-1-oxopropan-2-yl]carbamic acid is C[C@@H](NC(=O)O)C(=O)NN.
What is the InChIKey of [(2R)-1-hydrazinyl-1-oxopropan-2-yl]carbamic acid?
The InChIKey is QNLVZXDFMZCDMS-UWTATZPHSA-N. The full InChI is InChI=1S/C4H9N3O3/c1-2(3(8)7-5)6-4(9)10/h2,6H,5H2,1H3,(H,7,8)(H,9,10)/t2-/m1/s1.
What are the key properties of [(2R)-1-hydrazinyl-1-oxopropan-2-yl]carbamic acid?
[(2R)-1-hydrazinyl-1-oxopropan-2-yl]carbamic acid has a molecular weight of 147.13 g/mol, XLogP of -1.37, 2 rotatable bonds, 4 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for [(2R)-1-hydrazinyl-1-oxopropan-2-yl]carbamic acid is sourced from PubChem (CID 90311881), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).