(6,6,6-trifluoro-1-thiophen-3-ylhexan-3-yl)hydrazine

C10H15F3N2S — CID 105249014

IUPAC(6,6,6-trifluoro-1-thiophen-3-ylhexan-3-yl)hydrazine
SMILESNNC(CCc1ccsc1)CCC(F)(F)F
InChIInChI=1S/C10H15F3N2S/c11-10(12,13)5-3-9(15-14)2-1-8-4-6-16-7-8/h4,6-7,9,15H,1-3,5,14H2
InChIKeyPHNRFCSHQYLARG-UHFFFAOYSA-N
MW252.30 g/mol
LogP2.86
Rot. Bonds6

About (6,6,6-trifluoro-1-thiophen-3-ylhexan-3-yl)hydrazine

(6,6,6-trifluoro-1-thiophen-3-ylhexan-3-yl)hydrazine (PubChem CID 105249014) has the molecular formula C10H15F3N2S and a molecular weight of 252.30 g/mol. Its IUPAC name is (6,6,6-trifluoro-1-thiophen-3-ylhexan-3-yl)hydrazine.

Molecular Properties

Compound Name(6,6,6-trifluoro-1-thiophen-3-ylhexan-3-yl)hydrazine
PubChem CID105249014
Molecular FormulaC10H15F3N2S
Molecular Weight252.30 g/mol
Exact Mass252.09
IUPAC Name(6,6,6-trifluoro-1-thiophen-3-ylhexan-3-yl)hydrazine
SMILESNNC(CCc1ccsc1)CCC(F)(F)F
InChIInChI=1S/C10H15F3N2S/c11-10(12,13)5-3-9(15-14)2-1-8-4-6-16-7-8/h4,6-7,9,15H,1-3,5,14H2
InChIKeyPHNRFCSHQYLARG-UHFFFAOYSA-N
XLogP2.86
TPSA38.05 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds6
Heavy Atoms16
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500252.30
LogP ≤ 52.86
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

Structural Alerts{'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 (6,6,6-trifluoro-1-thiophen-3-ylhexan-3-yl)hydrazine?
The IUPAC name of (6,6,6-trifluoro-1-thiophen-3-ylhexan-3-yl)hydrazine (CID 105249014) is (6,6,6-trifluoro-1-thiophen-3-ylhexan-3-yl)hydrazine.
What is the SMILES notation for (6,6,6-trifluoro-1-thiophen-3-ylhexan-3-yl)hydrazine?
The canonical SMILES for (6,6,6-trifluoro-1-thiophen-3-ylhexan-3-yl)hydrazine is NNC(CCc1ccsc1)CCC(F)(F)F.
What is the InChIKey of (6,6,6-trifluoro-1-thiophen-3-ylhexan-3-yl)hydrazine?
The InChIKey is PHNRFCSHQYLARG-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H15F3N2S/c11-10(12,13)5-3-9(15-14)2-1-8-4-6-16-7-8/h4,6-7,9,15H,1-3,5,14H2.
What are the key properties of (6,6,6-trifluoro-1-thiophen-3-ylhexan-3-yl)hydrazine?
(6,6,6-trifluoro-1-thiophen-3-ylhexan-3-yl)hydrazine has a molecular weight of 252.30 g/mol, XLogP of 2.86, 6 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for (6,6,6-trifluoro-1-thiophen-3-ylhexan-3-yl)hydrazine is sourced from PubChem (CID 105249014), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).