2-ethyl-1,1-bis[(Z)-octadec-9-enyl]hydrazine

C38H76N2 — CID 87250860

IUPAC2-ethyl-1,1-bis[(Z)-octadec-9-enyl]hydrazine
SMILESCCCCCCCC/C=C\CCCCCCCCN(CCCCCCCC/C=C\CCCCCCCC)NCC
InChIInChI=1S/C38H76N2/c1-4-7-9-11-13-15-17-19-21-23-25-27-29-31-33-35-37-40(39-6-3)38-36-34-32-30-28-26-24-22-20-18-16-14-12-10-8-5-2/h19-22,39H,4-18,23-38H2,1-3H3/b21-19-,22-20-
InChIKeyDFQBKFOIBOJSRJ-WRBBJXAJSA-N
MW561.04 g/mol
LogP12.89
Rot. Bonds34

About 2-ethyl-1,1-bis[(Z)-octadec-9-enyl]hydrazine

2-ethyl-1,1-bis[(Z)-octadec-9-enyl]hydrazine (PubChem CID 87250860) has the molecular formula C38H76N2 and a molecular weight of 561.04 g/mol. Its IUPAC name is 2-ethyl-1,1-bis[(Z)-octadec-9-enyl]hydrazine.

Molecular Properties

Compound Name2-ethyl-1,1-bis[(Z)-octadec-9-enyl]hydrazine
PubChem CID87250860
Molecular FormulaC38H76N2
Molecular Weight561.04 g/mol
Exact Mass560.60
IUPAC Name2-ethyl-1,1-bis[(Z)-octadec-9-enyl]hydrazine
SMILESCCCCCCCC/C=C\CCCCCCCCN(CCCCCCCC/C=C\CCCCCCCC)NCC
InChIInChI=1S/C38H76N2/c1-4-7-9-11-13-15-17-19-21-23-25-27-29-31-33-35-37-40(39-6-3)38-36-34-32-30-28-26-24-22-20-18-16-14-12-10-8-5-2/h19-22,39H,4-18,23-38H2,1-3H3/b21-19-,22-20-
InChIKeyDFQBKFOIBOJSRJ-WRBBJXAJSA-N
XLogP12.89
TPSA15.27 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds34
Heavy Atoms40
Complexity—

Lipinski Rule of Five

2 violations

RuleValue
MW ≤ 500561.04
LogP ≤ 512.89
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Aliphatic_long_chain', 'substructure': 'N/A'}, {'alert_name': 'isolated_alkene', '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 2-ethyl-1,1-bis[(Z)-octadec-9-enyl]hydrazine?
The IUPAC name of 2-ethyl-1,1-bis[(Z)-octadec-9-enyl]hydrazine (CID 87250860) is 2-ethyl-1,1-bis[(Z)-octadec-9-enyl]hydrazine.
What is the SMILES notation for 2-ethyl-1,1-bis[(Z)-octadec-9-enyl]hydrazine?
The canonical SMILES for 2-ethyl-1,1-bis[(Z)-octadec-9-enyl]hydrazine is CCCCCCCC/C=C\CCCCCCCCN(CCCCCCCC/C=C\CCCCCCCC)NCC.
What is the InChIKey of 2-ethyl-1,1-bis[(Z)-octadec-9-enyl]hydrazine?
The InChIKey is DFQBKFOIBOJSRJ-WRBBJXAJSA-N. The full InChI is InChI=1S/C38H76N2/c1-4-7-9-11-13-15-17-19-21-23-25-27-29-31-33-35-37-40(39-6-3)38-36-34-32-30-28-26-24-22-20-18-16-14-12-10-8-5-2/h19-22,39H,4-18,23-38H2,1-3H3/b21-19-,22-20-.
What are the key properties of 2-ethyl-1,1-bis[(Z)-octadec-9-enyl]hydrazine?
2-ethyl-1,1-bis[(Z)-octadec-9-enyl]hydrazine has a molecular weight of 561.04 g/mol, XLogP of 12.89, 34 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-ethyl-1,1-bis[(Z)-octadec-9-enyl]hydrazine is sourced from PubChem (CID 87250860), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).