[1-[(1E)-cycloocten-1-yl]-2-(3,5-difluorophenyl)ethyl]hydrazine

C16H22F2N2 — CID 106648712

IUPAC[1-[(1E)-cycloocten-1-yl]-2-(3,5-difluorophenyl)ethyl]hydrazine
SMILESNNC(Cc1cc(F)cc(F)c1)/C1=C/CCCCCC1
InChIInChI=1S/C16H22F2N2/c17-14-8-12(9-15(18)11-14)10-16(20-19)13-6-4-2-1-3-5-7-13/h6,8-9,11,16,20H,1-5,7,10,19H2/b13-6+
InChIKeyWMQHGCXSDRLTSJ-AWNIVKPZSA-N
MW280.36 g/mol
LogP3.62
Rot. Bonds4

About [1-[(1E)-cycloocten-1-yl]-2-(3,5-difluorophenyl)ethyl]hydrazine

[1-[(1E)-cycloocten-1-yl]-2-(3,5-difluorophenyl)ethyl]hydrazine (PubChem CID 106648712) has the molecular formula C16H22F2N2 and a molecular weight of 280.36 g/mol. Its IUPAC name is [1-[(1E)-cycloocten-1-yl]-2-(3,5-difluorophenyl)ethyl]hydrazine.

Molecular Properties

Compound Name[1-[(1E)-cycloocten-1-yl]-2-(3,5-difluorophenyl)ethyl]hydrazine
PubChem CID106648712
Molecular FormulaC16H22F2N2
Molecular Weight280.36 g/mol
Exact Mass280.18
IUPAC Name[1-[(1E)-cycloocten-1-yl]-2-(3,5-difluorophenyl)ethyl]hydrazine
SMILESNNC(Cc1cc(F)cc(F)c1)/C1=C/CCCCCC1
InChIInChI=1S/C16H22F2N2/c17-14-8-12(9-15(18)11-14)10-16(20-19)13-6-4-2-1-3-5-7-13/h6,8-9,11,16,20H,1-5,7,10,19H2/b13-6+
InChIKeyWMQHGCXSDRLTSJ-AWNIVKPZSA-N
XLogP3.62
TPSA38.05 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500280.36
LogP ≤ 53.62
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

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

Analyze [1-[(1E)-cycloocten-1-yl]-2-(3,5-difluorophenyl)ethyl]hydrazine 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

[1-(cyclohepten-1-yl)-2-(3,5-difluorophenyl)ethyl]hydrazine
CID 106648713
[2-(4-bromophenyl)-1-(cyclohepten-1-yl)ethyl]hydrazine
CID 106648573
[2-(4-chlorophenyl)-1-[(1E)-cycloocten-1-yl]ethyl]hydrazine
CID 106648598
[1-(cyclohexen-1-yl)-2-thiophen-3-ylethyl]hydrazine
CID 106650433
[1-(cyclohexen-1-yl)-2-(2-fluorophenyl)ethyl]hydrazine
CID 106648715
[1-(cyclohexen-1-yl)-2-(3-methoxyphenyl)ethyl]hydrazine
CID 106648692
[1-(cyclohepten-1-yl)-3-methylbutyl]hydrazine
CID 106648613
1-(cyclohexen-1-yl)-2-(4-fluorophenyl)-N-methylethanamine
CID 62079036
[1-[(1E)-cycloocten-1-yl]-2-(2,6-dichlorophenyl)ethyl]hydrazine
CID 106648752
2-(cycloocten-1-yl)-2-hydrazinyl-N,N-dimethylethanamine
CID 106649237
[1-(cyclohepten-1-yl)-2-cycloheptylethyl]hydrazine
CID 106650401
cyclohepten-1-yl-(3,5-difluorophenyl)methanamine
CID 62080192

Frequently Asked Questions

What is the IUPAC name of [1-[(1E)-cycloocten-1-yl]-2-(3,5-difluorophenyl)ethyl]hydrazine?
The IUPAC name of [1-[(1E)-cycloocten-1-yl]-2-(3,5-difluorophenyl)ethyl]hydrazine (CID 106648712) is [1-[(1E)-cycloocten-1-yl]-2-(3,5-difluorophenyl)ethyl]hydrazine.
What is the SMILES notation for [1-[(1E)-cycloocten-1-yl]-2-(3,5-difluorophenyl)ethyl]hydrazine?
The canonical SMILES for [1-[(1E)-cycloocten-1-yl]-2-(3,5-difluorophenyl)ethyl]hydrazine is NNC(Cc1cc(F)cc(F)c1)/C1=C/CCCCCC1.
What is the InChIKey of [1-[(1E)-cycloocten-1-yl]-2-(3,5-difluorophenyl)ethyl]hydrazine?
The InChIKey is WMQHGCXSDRLTSJ-AWNIVKPZSA-N. The full InChI is InChI=1S/C16H22F2N2/c17-14-8-12(9-15(18)11-14)10-16(20-19)13-6-4-2-1-3-5-7-13/h6,8-9,11,16,20H,1-5,7,10,19H2/b13-6+.
What are the key properties of [1-[(1E)-cycloocten-1-yl]-2-(3,5-difluorophenyl)ethyl]hydrazine?
[1-[(1E)-cycloocten-1-yl]-2-(3,5-difluorophenyl)ethyl]hydrazine has a molecular weight of 280.36 g/mol, XLogP of 3.62, 4 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for [1-[(1E)-cycloocten-1-yl]-2-(3,5-difluorophenyl)ethyl]hydrazine is sourced from PubChem (CID 106648712), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).