[1-[(1E)-cycloocten-1-yl]-4-thiophen-2-ylbutyl]hydrazine

C16H26N2S — CID 106650086

IUPAC[1-[(1E)-cycloocten-1-yl]-4-thiophen-2-ylbutyl]hydrazine
SMILESNNC(CCCc1cccs1)/C1=C/CCCCCC1
InChIInChI=1S/C16H26N2S/c17-18-16(12-6-10-15-11-7-13-19-15)14-8-4-2-1-3-5-9-14/h7-8,11,13,16,18H,1-6,9-10,12,17H2/b14-8+
InChIKeyQCVRWAANERUTKD-RIYZIHGNSA-N
MW278.46 g/mol
LogP4.18
Rot. Bonds6

About [1-[(1E)-cycloocten-1-yl]-4-thiophen-2-ylbutyl]hydrazine

[1-[(1E)-cycloocten-1-yl]-4-thiophen-2-ylbutyl]hydrazine (PubChem CID 106650086) has the molecular formula C16H26N2S and a molecular weight of 278.46 g/mol. Its IUPAC name is [1-[(1E)-cycloocten-1-yl]-4-thiophen-2-ylbutyl]hydrazine.

Molecular Properties

Compound Name[1-[(1E)-cycloocten-1-yl]-4-thiophen-2-ylbutyl]hydrazine
PubChem CID106650086
Molecular FormulaC16H26N2S
Molecular Weight278.46 g/mol
Exact Mass278.18
IUPAC Name[1-[(1E)-cycloocten-1-yl]-4-thiophen-2-ylbutyl]hydrazine
SMILESNNC(CCCc1cccs1)/C1=C/CCCCCC1
InChIInChI=1S/C16H26N2S/c17-18-16(12-6-10-15-11-7-13-19-15)14-8-4-2-1-3-5-9-14/h7-8,11,13,16,18H,1-6,9-10,12,17H2/b14-8+
InChIKeyQCVRWAANERUTKD-RIYZIHGNSA-N
XLogP4.18
TPSA38.05 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds6
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500278.46
LogP ≤ 54.18
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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]-4-thiophen-2-ylbutyl]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-[(1E)-cycloocten-1-yl]-2-thiophen-2-ylethanol
CID 106657625
[1-(4-ethylphenyl)-4-thiophen-2-ylbutyl]hydrazine
CID 105292889
[1-(cyclohepten-1-yl)-3-(4-methylphenyl)propyl]hydrazine
CID 106650193
[1-(furan-3-yl)-4-thiophen-2-ylbutyl]hydrazine
CID 105305888
[2-(4-chlorophenyl)-1-[(1E)-cycloocten-1-yl]ethyl]hydrazine
CID 106648598
1-(3,4-dihydro-2H-pyran-6-yl)-4-thiophen-2-ylbutan-1-amine
CID 102649485
cyclohexen-1-yl(thiophen-2-yl)methanamine
CID 62078485
(1-pyrazin-2-yl-4-thiophen-2-ylbutyl)hydrazine
CID 105308717
(2-methyl-6-thiophen-2-ylhexan-3-yl)hydrazine
CID 105281740
[1-(1-methylpyrazol-3-yl)-4-thiophen-2-ylbutyl]hydrazine
CID 103141110
[1-(cyclohepten-1-yl)-3-methylbutyl]hydrazine
CID 106648613
[1-(3-methyltriazol-4-yl)-4-thiophen-2-ylbutyl]hydrazine
CID 105337635

Frequently Asked Questions

What is the IUPAC name of [1-[(1E)-cycloocten-1-yl]-4-thiophen-2-ylbutyl]hydrazine?
The IUPAC name of [1-[(1E)-cycloocten-1-yl]-4-thiophen-2-ylbutyl]hydrazine (CID 106650086) is [1-[(1E)-cycloocten-1-yl]-4-thiophen-2-ylbutyl]hydrazine.
What is the SMILES notation for [1-[(1E)-cycloocten-1-yl]-4-thiophen-2-ylbutyl]hydrazine?
The canonical SMILES for [1-[(1E)-cycloocten-1-yl]-4-thiophen-2-ylbutyl]hydrazine is NNC(CCCc1cccs1)/C1=C/CCCCCC1.
What is the InChIKey of [1-[(1E)-cycloocten-1-yl]-4-thiophen-2-ylbutyl]hydrazine?
The InChIKey is QCVRWAANERUTKD-RIYZIHGNSA-N. The full InChI is InChI=1S/C16H26N2S/c17-18-16(12-6-10-15-11-7-13-19-15)14-8-4-2-1-3-5-9-14/h7-8,11,13,16,18H,1-6,9-10,12,17H2/b14-8+.
What are the key properties of [1-[(1E)-cycloocten-1-yl]-4-thiophen-2-ylbutyl]hydrazine?
[1-[(1E)-cycloocten-1-yl]-4-thiophen-2-ylbutyl]hydrazine has a molecular weight of 278.46 g/mol, XLogP of 4.18, 6 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for [1-[(1E)-cycloocten-1-yl]-4-thiophen-2-ylbutyl]hydrazine is sourced from PubChem (CID 106650086), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).