1-thiophen-2-yltetradecan-4-ylhydrazine

C18H34N2S — CID 105298385

IUPAC1-thiophen-2-yltetradecan-4-ylhydrazine
SMILESCCCCCCCCCCC(CCCc1cccs1)NN
InChIInChI=1S/C18H34N2S/c1-2-3-4-5-6-7-8-9-12-17(20-19)13-10-14-18-15-11-16-21-18/h11,15-17,20H,2-10,12-14,19H2,1H3
InChIKeyDBYTZUMGTLDGKR-UHFFFAOYSA-N
MW310.55 g/mol
LogP5.43
Rot. Bonds14

About 1-thiophen-2-yltetradecan-4-ylhydrazine

1-thiophen-2-yltetradecan-4-ylhydrazine (PubChem CID 105298385) has the molecular formula C18H34N2S and a molecular weight of 310.55 g/mol. Its IUPAC name is 1-thiophen-2-yltetradecan-4-ylhydrazine.

Molecular Properties

Compound Name1-thiophen-2-yltetradecan-4-ylhydrazine
PubChem CID105298385
Molecular FormulaC18H34N2S
Molecular Weight310.55 g/mol
Exact Mass310.24
IUPAC Name1-thiophen-2-yltetradecan-4-ylhydrazine
SMILESCCCCCCCCCCC(CCCc1cccs1)NN
InChIInChI=1S/C18H34N2S/c1-2-3-4-5-6-7-8-9-12-17(20-19)13-10-14-18-15-11-16-21-18/h11,15-17,20H,2-10,12-14,19H2,1H3
InChIKeyDBYTZUMGTLDGKR-UHFFFAOYSA-N
XLogP5.43
TPSA38.05 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds14
Heavy Atoms21
Complexity

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500310.55
LogP ≤ 55.43
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Aliphatic_long_chain', 'substructure': 'N/A'}, {'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 1-thiophen-2-yltetradecan-4-ylhydrazine?
The IUPAC name of 1-thiophen-2-yltetradecan-4-ylhydrazine (CID 105298385) is 1-thiophen-2-yltetradecan-4-ylhydrazine.
What is the SMILES notation for 1-thiophen-2-yltetradecan-4-ylhydrazine?
The canonical SMILES for 1-thiophen-2-yltetradecan-4-ylhydrazine is CCCCCCCCCCC(CCCc1cccs1)NN.
What is the InChIKey of 1-thiophen-2-yltetradecan-4-ylhydrazine?
The InChIKey is DBYTZUMGTLDGKR-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H34N2S/c1-2-3-4-5-6-7-8-9-12-17(20-19)13-10-14-18-15-11-16-21-18/h11,15-17,20H,2-10,12-14,19H2,1H3.
What are the key properties of 1-thiophen-2-yltetradecan-4-ylhydrazine?
1-thiophen-2-yltetradecan-4-ylhydrazine has a molecular weight of 310.55 g/mol, XLogP of 5.43, 14 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 1-thiophen-2-yltetradecan-4-ylhydrazine is sourced from PubChem (CID 105298385), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).