[3-(2-methylimidazol-1-yl)-5-nitrophenyl]hydrazine

C10H11N5O2 — CID 80902141

IUPAC[3-(2-methylimidazol-1-yl)-5-nitrophenyl]hydrazine
SMILESCc1nccn1-c1cc(NN)cc([N+](=O)[O-])c1
InChIInChI=1S/C10H11N5O2/c1-7-12-2-3-14(7)9-4-8(13-11)5-10(6-9)15(16)17/h2-6,13H,11H2,1H3
InChIKeyONZTZAGIESSNLH-UHFFFAOYSA-N
MW233.23 g/mol
LogP1.37
Rot. Bonds3

About [3-(2-methylimidazol-1-yl)-5-nitrophenyl]hydrazine

[3-(2-methylimidazol-1-yl)-5-nitrophenyl]hydrazine (PubChem CID 80902141) has the molecular formula C10H11N5O2 and a molecular weight of 233.23 g/mol. Its IUPAC name is [3-(2-methylimidazol-1-yl)-5-nitrophenyl]hydrazine.

Molecular Properties

Compound Name[3-(2-methylimidazol-1-yl)-5-nitrophenyl]hydrazine
PubChem CID80902141
Molecular FormulaC10H11N5O2
Molecular Weight233.23 g/mol
Exact Mass233.09
IUPAC Name[3-(2-methylimidazol-1-yl)-5-nitrophenyl]hydrazine
SMILESCc1nccn1-c1cc(NN)cc([N+](=O)[O-])c1
InChIInChI=1S/C10H11N5O2/c1-7-12-2-3-14(7)9-4-8(13-11)5-10(6-9)15(16)17/h2-6,13H,11H2,1H3
InChIKeyONZTZAGIESSNLH-UHFFFAOYSA-N
XLogP1.37
TPSA99.01 Ų
H-Bond Donors2
H-Bond Acceptors6
Rotatable Bonds3
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500233.23
LogP ≤ 51.37
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 106

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'}

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Related Compounds

2-methyl-1-(3-nitrophenyl)imidazole
CID 59199671
[3-(3,5-dimethylpyrazol-1-yl)-5-nitrophenyl]hydrazine
CID 80900658
1-(3-hydrazinyl-5-nitrophenyl)pyrrolidine-3,4-diol
CID 106674650
1-(3-hydrazinyl-5-nitrophenyl)piperidin-4-ol
CID 80931571
[3-(2,6-dimethylthiomorpholin-4-yl)-5-nitrophenyl]hydrazine
CID 80912767
3-(4,5-dimethylimidazol-1-yl)-N-ethyl-5-nitroaniline
CID 80857632
3-hydrazinyl-N-[(5-methyl-1,3-oxazol-2-yl)methyl]-5-nitroaniline
CID 114181142
3-hydrazinyl-5-nitro-N-propan-2-ylaniline
CID 80932452
1-(3-methoxy-4-nitrophenyl)-2-methylimidazole
CID 11424789
[3-nitro-5-(3-propan-2-ylpyrrolidin-1-yl)phenyl]hydrazine
CID 113419535
2-[[(1S)-1-[4-(2-methylimidazol-1-yl)phenyl]ethyl]amino]-5-nitropyridine-3-carboxamide
CID 95974455
3-imidazol-1-yl-N-methyl-5-nitroaniline
CID 80853139

Frequently Asked Questions

What is the IUPAC name of [3-(2-methylimidazol-1-yl)-5-nitrophenyl]hydrazine?
The IUPAC name of [3-(2-methylimidazol-1-yl)-5-nitrophenyl]hydrazine (CID 80902141) is [3-(2-methylimidazol-1-yl)-5-nitrophenyl]hydrazine.
What is the SMILES notation for [3-(2-methylimidazol-1-yl)-5-nitrophenyl]hydrazine?
The canonical SMILES for [3-(2-methylimidazol-1-yl)-5-nitrophenyl]hydrazine is Cc1nccn1-c1cc(NN)cc([N+](=O)[O-])c1.
What is the InChIKey of [3-(2-methylimidazol-1-yl)-5-nitrophenyl]hydrazine?
The InChIKey is ONZTZAGIESSNLH-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H11N5O2/c1-7-12-2-3-14(7)9-4-8(13-11)5-10(6-9)15(16)17/h2-6,13H,11H2,1H3.
What are the key properties of [3-(2-methylimidazol-1-yl)-5-nitrophenyl]hydrazine?
[3-(2-methylimidazol-1-yl)-5-nitrophenyl]hydrazine has a molecular weight of 233.23 g/mol, XLogP of 1.37, 3 rotatable bonds, 2 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for [3-(2-methylimidazol-1-yl)-5-nitrophenyl]hydrazine is sourced from PubChem (CID 80902141), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).