1-(3-hydrazinyl-5-nitrophenyl)pyrrolidine-3,4-diol

C10H14N4O4 — CID 106674650

IUPAC1-(3-hydrazinyl-5-nitrophenyl)pyrrolidine-3,4-diol
SMILESNNc1cc(N2CC(O)C(O)C2)cc([N+](=O)[O-])c1
InChIInChI=1S/C10H14N4O4/c11-12-6-1-7(3-8(2-6)14(17)18)13-4-9(15)10(16)5-13/h1-3,9-10,12,15-16H,4-5,11H2
InChIKeyGLJPRUMGMOHDOD-UHFFFAOYSA-N
MW254.25 g/mol
LogP-0.58
Rot. Bonds3

About 1-(3-hydrazinyl-5-nitrophenyl)pyrrolidine-3,4-diol

1-(3-hydrazinyl-5-nitrophenyl)pyrrolidine-3,4-diol (PubChem CID 106674650) has the molecular formula C10H14N4O4 and a molecular weight of 254.25 g/mol. Its IUPAC name is 1-(3-hydrazinyl-5-nitrophenyl)pyrrolidine-3,4-diol.

Molecular Properties

Compound Name1-(3-hydrazinyl-5-nitrophenyl)pyrrolidine-3,4-diol
PubChem CID106674650
Molecular FormulaC10H14N4O4
Molecular Weight254.25 g/mol
Exact Mass254.10
IUPAC Name1-(3-hydrazinyl-5-nitrophenyl)pyrrolidine-3,4-diol
SMILESNNc1cc(N2CC(O)C(O)C2)cc([N+](=O)[O-])c1
InChIInChI=1S/C10H14N4O4/c11-12-6-1-7(3-8(2-6)14(17)18)13-4-9(15)10(16)5-13/h1-3,9-10,12,15-16H,4-5,11H2
InChIKeyGLJPRUMGMOHDOD-UHFFFAOYSA-N
XLogP-0.58
TPSA124.89 Ų
H-Bond Donors4
H-Bond Acceptors7
Rotatable Bonds3
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500254.25
LogP ≤ 5-0.58
H-Bond Donors ≤ 54
H-Bond Acceptors ≤ 107

Computed Properties (RDKit)

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

Analyze 1-(3-hydrazinyl-5-nitrophenyl)pyrrolidine-3,4-diol 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

1-(3-hydrazinyl-5-nitrophenyl)piperidin-4-ol
CID 80931571
[3-(2,6-dimethylthiomorpholin-4-yl)-5-nitrophenyl]hydrazine
CID 80912767
[3-nitro-5-(3-propan-2-ylpyrrolidin-1-yl)phenyl]hydrazine
CID 113419535
[3-(3-methoxy-4-methylpiperidin-1-yl)-5-nitrophenyl]hydrazine
CID 102971959
[1-(3-hydrazinyl-5-nitrophenyl)pyrrolidin-2-yl]methanol
CID 80898618
3-(2,6-dimethylmorpholin-4-yl)-N-methyl-5-nitroaniline
CID 80763894
[3-(3-methyl-1,1-dioxo-1,4-thiazinan-4-yl)-5-nitrophenyl]hydrazine
CID 102887930
1-[3-(ethylamino)-5-nitrophenyl]piperidin-4-ol
CID 80763699
[3-(3,5-dimethylpyrazol-1-yl)-5-nitrophenyl]hydrazine
CID 80900658
4-(3-hydrazinyl-5-nitrophenyl)-N-methylmorpholine-3-carboxamide
CID 83104244
[3-(2-methylimidazol-1-yl)-5-nitrophenyl]hydrazine
CID 80902141
[1-[3-(methylamino)-5-nitrophenyl]pyrrolidin-3-yl]methanol
CID 112629547

Frequently Asked Questions

What is the IUPAC name of 1-(3-hydrazinyl-5-nitrophenyl)pyrrolidine-3,4-diol?
The IUPAC name of 1-(3-hydrazinyl-5-nitrophenyl)pyrrolidine-3,4-diol (CID 106674650) is 1-(3-hydrazinyl-5-nitrophenyl)pyrrolidine-3,4-diol.
What is the SMILES notation for 1-(3-hydrazinyl-5-nitrophenyl)pyrrolidine-3,4-diol?
The canonical SMILES for 1-(3-hydrazinyl-5-nitrophenyl)pyrrolidine-3,4-diol is NNc1cc(N2CC(O)C(O)C2)cc([N+](=O)[O-])c1.
What is the InChIKey of 1-(3-hydrazinyl-5-nitrophenyl)pyrrolidine-3,4-diol?
The InChIKey is GLJPRUMGMOHDOD-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H14N4O4/c11-12-6-1-7(3-8(2-6)14(17)18)13-4-9(15)10(16)5-13/h1-3,9-10,12,15-16H,4-5,11H2.
What are the key properties of 1-(3-hydrazinyl-5-nitrophenyl)pyrrolidine-3,4-diol?
1-(3-hydrazinyl-5-nitrophenyl)pyrrolidine-3,4-diol has a molecular weight of 254.25 g/mol, XLogP of -0.58, 3 rotatable bonds, 4 hydrogen bond donors, and 7 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(3-hydrazinyl-5-nitrophenyl)pyrrolidine-3,4-diol is sourced from PubChem (CID 106674650), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).