N,N-diethylethanamine;(4-methylphenyl)hydrazine;hydrochloride

C13H26ClN3 — CID 86685442

IUPACN,N-diethylethanamine;(4-methylphenyl)hydrazine;hydrochloride
SMILESCCN(CC)CC.Cc1ccc(NN)cc1.Cl
InChIInChI=1S/C7H10N2.C6H15N.ClH/c1-6-2-4-7(9-8)5-3-6;1-4-7(5-2)6-3;/h2-5,9H,8H2,1H3;4-6H2,1-3H3;1H
InChIKeyGCIUBZXKHKKISP-UHFFFAOYSA-N
MW259.83 g/mol
LogP3.05
Rot. Bonds4

About N,N-diethylethanamine;(4-methylphenyl)hydrazine;hydrochloride

N,N-diethylethanamine;(4-methylphenyl)hydrazine;hydrochloride (PubChem CID 86685442) has the molecular formula C13H26ClN3 and a molecular weight of 259.83 g/mol. Its IUPAC name is N,N-diethylethanamine;(4-methylphenyl)hydrazine;hydrochloride.

Molecular Properties

Compound NameN,N-diethylethanamine;(4-methylphenyl)hydrazine;hydrochloride
PubChem CID86685442
Molecular FormulaC13H26ClN3
Molecular Weight259.83 g/mol
Exact Mass259.18
IUPAC NameN,N-diethylethanamine;(4-methylphenyl)hydrazine;hydrochloride
SMILESCCN(CC)CC.Cc1ccc(NN)cc1.Cl
InChIInChI=1S/C7H10N2.C6H15N.ClH/c1-6-2-4-7(9-8)5-3-6;1-4-7(5-2)6-3;/h2-5,9H,8H2,1H3;4-6H2,1-3H3;1H
InChIKeyGCIUBZXKHKKISP-UHFFFAOYSA-N
XLogP3.05
TPSA41.29 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500259.83
LogP ≤ 53.05
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

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

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Frequently Asked Questions

What is the IUPAC name of N,N-diethylethanamine;(4-methylphenyl)hydrazine;hydrochloride?
The IUPAC name of N,N-diethylethanamine;(4-methylphenyl)hydrazine;hydrochloride (CID 86685442) is N,N-diethylethanamine;(4-methylphenyl)hydrazine;hydrochloride.
What is the SMILES notation for N,N-diethylethanamine;(4-methylphenyl)hydrazine;hydrochloride?
The canonical SMILES for N,N-diethylethanamine;(4-methylphenyl)hydrazine;hydrochloride is CCN(CC)CC.Cc1ccc(NN)cc1.Cl.
What is the InChIKey of N,N-diethylethanamine;(4-methylphenyl)hydrazine;hydrochloride?
The InChIKey is GCIUBZXKHKKISP-UHFFFAOYSA-N. The full InChI is InChI=1S/C7H10N2.C6H15N.ClH/c1-6-2-4-7(9-8)5-3-6;1-4-7(5-2)6-3;/h2-5,9H,8H2,1H3;4-6H2,1-3H3;1H.
What are the key properties of N,N-diethylethanamine;(4-methylphenyl)hydrazine;hydrochloride?
N,N-diethylethanamine;(4-methylphenyl)hydrazine;hydrochloride has a molecular weight of 259.83 g/mol, XLogP of 3.05, 4 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N,N-diethylethanamine;(4-methylphenyl)hydrazine;hydrochloride is sourced from PubChem (CID 86685442), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).