2-(4-nitrophenyl)ethylhydrazine;hydrochloride

C8H12ClN3O2 — CID 69415897

IUPAC2-(4-nitrophenyl)ethylhydrazine;hydrochloride
SMILESCl.NNCCc1ccc([N+](=O)[O-])cc1
InChIInChI=1S/C8H11N3O2.ClH/c9-10-6-5-7-1-3-8(4-2-7)11(12)13;/h1-4,10H,5-6,9H2;1H
InChIKeyUBWZIGKDTNHBGZ-UHFFFAOYSA-N
MW217.66 g/mol
LogP1.02
Rot. Bonds4

About 2-(4-nitrophenyl)ethylhydrazine;hydrochloride

2-(4-nitrophenyl)ethylhydrazine;hydrochloride (PubChem CID 69415897) has the molecular formula C8H12ClN3O2 and a molecular weight of 217.66 g/mol. Its IUPAC name is 2-(4-nitrophenyl)ethylhydrazine;hydrochloride.

Molecular Properties

Compound Name2-(4-nitrophenyl)ethylhydrazine;hydrochloride
PubChem CID69415897
Molecular FormulaC8H12ClN3O2
Molecular Weight217.66 g/mol
Exact Mass217.06
IUPAC Name2-(4-nitrophenyl)ethylhydrazine;hydrochloride
SMILESCl.NNCCc1ccc([N+](=O)[O-])cc1
InChIInChI=1S/C8H11N3O2.ClH/c9-10-6-5-7-1-3-8(4-2-7)11(12)13;/h1-4,10H,5-6,9H2;1H
InChIKeyUBWZIGKDTNHBGZ-UHFFFAOYSA-N
XLogP1.02
TPSA81.19 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500217.66
LogP ≤ 51.02
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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 2-(4-nitrophenyl)ethylhydrazine;hydrochloride 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

N-[2-(4-nitrophenyl)ethyl]-2-phenylethanamine
CID 43519927
N-[2-(4-nitrophenyl)ethyl]formamide
CID 64992334
2-(4-nitrophenyl)ethylthiourea
CID 24973175
2-amino-N-[2-(4-nitrophenyl)ethyl]acetamide
CID 61218715
2-(4-nitrophenyl)ethylazanium nitrate
CID 140513510
2-(4-chlorophenyl)-N-[(4-nitrophenyl)methyl]ethanamine;hydrochloride
CID 17208597
1-amino-N-[2-(4-nitrophenyl)ethyl]cyclopropane-1-carboxamide
CID 65464485
2-chloro-N-[2-(4-nitrophenyl)ethyl]acetamide
CID 22505904
4-[2-[(4-nitrophenyl)methylamino]ethyl]benzenesulfonamide
CID 4718991
4-(4-nitrophenyl)butane-1,2-diamine
CID 13050183
N-[2-(4-nitrophenyl)ethyl]cyclopentanamine
CID 43519882
N-[2-(4-nitrophenyl)ethyl]pyrimidin-2-amine
CID 47350744

Frequently Asked Questions

What is the IUPAC name of 2-(4-nitrophenyl)ethylhydrazine;hydrochloride?
The IUPAC name of 2-(4-nitrophenyl)ethylhydrazine;hydrochloride (CID 69415897) is 2-(4-nitrophenyl)ethylhydrazine;hydrochloride.
What is the SMILES notation for 2-(4-nitrophenyl)ethylhydrazine;hydrochloride?
The canonical SMILES for 2-(4-nitrophenyl)ethylhydrazine;hydrochloride is Cl.NNCCc1ccc([N+](=O)[O-])cc1.
What is the InChIKey of 2-(4-nitrophenyl)ethylhydrazine;hydrochloride?
The InChIKey is UBWZIGKDTNHBGZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H11N3O2.ClH/c9-10-6-5-7-1-3-8(4-2-7)11(12)13;/h1-4,10H,5-6,9H2;1H.
What are the key properties of 2-(4-nitrophenyl)ethylhydrazine;hydrochloride?
2-(4-nitrophenyl)ethylhydrazine;hydrochloride has a molecular weight of 217.66 g/mol, XLogP of 1.02, 4 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(4-nitrophenyl)ethylhydrazine;hydrochloride is sourced from PubChem (CID 69415897), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).