(2-nitro-3-piperidin-1-ylphenyl)hydrazine

C11H16N4O2 — CID 80913842

IUPAC(2-nitro-3-piperidin-1-ylphenyl)hydrazine
SMILESNNc1cccc(N2CCCCC2)c1[N+](=O)[O-]
InChIInChI=1S/C11H16N4O2/c12-13-9-5-4-6-10(11(9)15(16)17)14-7-2-1-3-8-14/h4-6,13H,1-3,7-8,12H2
InChIKeyGSYOMXMZZWOLLU-UHFFFAOYSA-N
MW236.27 g/mol
LogP1.87
Rot. Bonds3

About (2-nitro-3-piperidin-1-ylphenyl)hydrazine

(2-nitro-3-piperidin-1-ylphenyl)hydrazine (PubChem CID 80913842) has the molecular formula C11H16N4O2 and a molecular weight of 236.27 g/mol. Its IUPAC name is (2-nitro-3-piperidin-1-ylphenyl)hydrazine.

Molecular Properties

Compound Name(2-nitro-3-piperidin-1-ylphenyl)hydrazine
PubChem CID80913842
Molecular FormulaC11H16N4O2
Molecular Weight236.27 g/mol
Exact Mass236.13
IUPAC Name(2-nitro-3-piperidin-1-ylphenyl)hydrazine
SMILESNNc1cccc(N2CCCCC2)c1[N+](=O)[O-]
InChIInChI=1S/C11H16N4O2/c12-13-9-5-4-6-10(11(9)15(16)17)14-7-2-1-3-8-14/h4-6,13H,1-3,7-8,12H2
InChIKeyGSYOMXMZZWOLLU-UHFFFAOYSA-N
XLogP1.87
TPSA84.43 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds3
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500236.27
LogP ≤ 51.87
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

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

[3-(4,4-dimethylazepan-1-yl)-2-nitrophenyl]hydrazine
CID 80931283
[3-(3-methylpiperidin-1-yl)-2-nitrophenyl]hydrazine
CID 80927463
[3-(4-cyclopropylpiperazin-1-yl)-2-nitrophenyl]hydrazine
CID 80900424
[3-(4-ethylazepan-1-yl)-2-nitrophenyl]hydrazine
CID 80918182
[3-(3-methylpyrrolidin-1-yl)-2-nitrophenyl]hydrazine
CID 80898807
1-(3-hydrazinyl-2-nitrophenyl)pyrrolidin-3-ol
CID 80919019
1-[1-(3-hydrazinyl-2-nitrophenyl)piperidin-4-yl]-N,N-dimethylmethanamine
CID 80902402
1-(2-nitro-3-phenylphenyl)piperidine
CID 139243136
N-methyl-2-nitro-3-thiomorpholin-4-ylaniline
CID 80764698
3-fluoro-2-nitro-N-[(2-piperidin-1-ylphenyl)methyl]aniline
CID 133439770
(3-imidazol-1-yl-2-nitrophenyl)hydrazine
CID 80901312
[3-(2-azabicyclo[2.2.1]heptan-2-yl)-2-nitrophenyl]hydrazine
CID 80904465

Frequently Asked Questions

What is the IUPAC name of (2-nitro-3-piperidin-1-ylphenyl)hydrazine?
The IUPAC name of (2-nitro-3-piperidin-1-ylphenyl)hydrazine (CID 80913842) is (2-nitro-3-piperidin-1-ylphenyl)hydrazine.
What is the SMILES notation for (2-nitro-3-piperidin-1-ylphenyl)hydrazine?
The canonical SMILES for (2-nitro-3-piperidin-1-ylphenyl)hydrazine is NNc1cccc(N2CCCCC2)c1[N+](=O)[O-].
What is the InChIKey of (2-nitro-3-piperidin-1-ylphenyl)hydrazine?
The InChIKey is GSYOMXMZZWOLLU-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H16N4O2/c12-13-9-5-4-6-10(11(9)15(16)17)14-7-2-1-3-8-14/h4-6,13H,1-3,7-8,12H2.
What are the key properties of (2-nitro-3-piperidin-1-ylphenyl)hydrazine?
(2-nitro-3-piperidin-1-ylphenyl)hydrazine has a molecular weight of 236.27 g/mol, XLogP of 1.87, 3 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for (2-nitro-3-piperidin-1-ylphenyl)hydrazine is sourced from PubChem (CID 80913842), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).