1-ethyl-2-octadecyl-1-propylhydrazine;hydrochloride

C23H51ClN2 — CID 174390243

IUPAC1-ethyl-2-octadecyl-1-propylhydrazine;hydrochloride
SMILESCCCCCCCCCCCCCCCCCCNN(CC)CCC.Cl
InChIInChI=1S/C23H50N2.ClH/c1-4-7-8-9-10-11-12-13-14-15-16-17-18-19-20-21-22-24-25(6-3)23-5-2;/h24H,4-23H2,1-3H3;1H
InChIKeyKHHUOIMCOUNMJZ-UHFFFAOYSA-N
MW391.13 g/mol
LogP7.91
Rot. Bonds21

About 1-ethyl-2-octadecyl-1-propylhydrazine;hydrochloride

1-ethyl-2-octadecyl-1-propylhydrazine;hydrochloride (PubChem CID 174390243) has the molecular formula C23H51ClN2 and a molecular weight of 391.13 g/mol. Its IUPAC name is 1-ethyl-2-octadecyl-1-propylhydrazine;hydrochloride.

Molecular Properties

Compound Name1-ethyl-2-octadecyl-1-propylhydrazine;hydrochloride
PubChem CID174390243
Molecular FormulaC23H51ClN2
Molecular Weight391.13 g/mol
Exact Mass390.37
IUPAC Name1-ethyl-2-octadecyl-1-propylhydrazine;hydrochloride
SMILESCCCCCCCCCCCCCCCCCCNN(CC)CCC.Cl
InChIInChI=1S/C23H50N2.ClH/c1-4-7-8-9-10-11-12-13-14-15-16-17-18-19-20-21-22-24-25(6-3)23-5-2;/h24H,4-23H2,1-3H3;1H
InChIKeyKHHUOIMCOUNMJZ-UHFFFAOYSA-N
XLogP7.91
TPSA15.27 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds21
Heavy Atoms26
Complexity

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500391.13
LogP ≤ 57.91
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Aliphatic_long_chain', '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 1-ethyl-2-octadecyl-1-propylhydrazine;hydrochloride?
The IUPAC name of 1-ethyl-2-octadecyl-1-propylhydrazine;hydrochloride (CID 174390243) is 1-ethyl-2-octadecyl-1-propylhydrazine;hydrochloride.
What is the SMILES notation for 1-ethyl-2-octadecyl-1-propylhydrazine;hydrochloride?
The canonical SMILES for 1-ethyl-2-octadecyl-1-propylhydrazine;hydrochloride is CCCCCCCCCCCCCCCCCCNN(CC)CCC.Cl.
What is the InChIKey of 1-ethyl-2-octadecyl-1-propylhydrazine;hydrochloride?
The InChIKey is KHHUOIMCOUNMJZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C23H50N2.ClH/c1-4-7-8-9-10-11-12-13-14-15-16-17-18-19-20-21-22-24-25(6-3)23-5-2;/h24H,4-23H2,1-3H3;1H.
What are the key properties of 1-ethyl-2-octadecyl-1-propylhydrazine;hydrochloride?
1-ethyl-2-octadecyl-1-propylhydrazine;hydrochloride has a molecular weight of 391.13 g/mol, XLogP of 7.91, 21 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 1-ethyl-2-octadecyl-1-propylhydrazine;hydrochloride is sourced from PubChem (CID 174390243), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).