[1-(cycloocten-1-yl)-3,3,3-trifluoropropyl]hydrazine

C11H19F3N2 — CID 106648704

IUPAC[1-(cycloocten-1-yl)-3,3,3-trifluoropropyl]hydrazine
SMILESNNC(CC(F)(F)F)C1=CCCCCCC1
InChIInChI=1S/C11H19F3N2/c12-11(13,14)8-10(16-15)9-6-4-2-1-3-5-7-9/h6,10,16H,1-5,7-8,15H2
InChIKeyUEBRAFKCPMKFNU-UHFFFAOYSA-N
MW236.28 g/mol
LogP3.05
Rot. Bonds3

About [1-(cycloocten-1-yl)-3,3,3-trifluoropropyl]hydrazine

[1-(cycloocten-1-yl)-3,3,3-trifluoropropyl]hydrazine (PubChem CID 106648704) has the molecular formula C11H19F3N2 and a molecular weight of 236.28 g/mol. Its IUPAC name is [1-(cycloocten-1-yl)-3,3,3-trifluoropropyl]hydrazine.

Molecular Properties

Compound Name[1-(cycloocten-1-yl)-3,3,3-trifluoropropyl]hydrazine
PubChem CID106648704
Molecular FormulaC11H19F3N2
Molecular Weight236.28 g/mol
Exact Mass236.15
IUPAC Name[1-(cycloocten-1-yl)-3,3,3-trifluoropropyl]hydrazine
SMILESNNC(CC(F)(F)F)C1=CCCCCCC1
InChIInChI=1S/C11H19F3N2/c12-11(13,14)8-10(16-15)9-6-4-2-1-3-5-7-9/h6,10,16H,1-5,7-8,15H2
InChIKeyUEBRAFKCPMKFNU-UHFFFAOYSA-N
XLogP3.05
TPSA38.05 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500236.28
LogP ≤ 53.05
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'}

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Related Compounds

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CID 22825120
5,5-Difluoro-3-hexylpent-2-ene-1,4-diamine
CID 54552133
(E)-6,6-difluoro-2-hexylhex-2-ene-1,5-diamine
CID 88698954
[(4Z)-6,6-difluorocyclooct-4-en-1-yl]hydrazine
CID 156051063
1,1,1-Trifluoronon-8-en-4-ylhydrazine
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(1,1,1-Trifluoro-7-methyloct-7-en-4-yl)hydrazine
CID 105248965
(1,1,1-Trifluoro-6-methylideneoctan-4-yl)hydrazine
CID 105249074
(7,7,7-Trifluoro-2-methylhept-2-en-4-yl)hydrazine
CID 105249101
[1-(Cyclohexen-1-yl)-5,5,5-trifluoropentan-2-yl]hydrazine
CID 105269859
[1-(Cyclohexen-1-yl)-6,6,6-trifluorohexan-2-yl]hydrazine
CID 105269964
[1-(4,4-Difluorocyclohexyl)-3-methylbut-2-enyl]hydrazine
CID 105319872
[1-(Cyclohexen-1-yl)-3,3,3-trifluoropropyl]hydrazine
CID 106648703

Frequently Asked Questions

What is the IUPAC name of [1-(cycloocten-1-yl)-3,3,3-trifluoropropyl]hydrazine?
The IUPAC name of [1-(cycloocten-1-yl)-3,3,3-trifluoropropyl]hydrazine (CID 106648704) is [1-(cycloocten-1-yl)-3,3,3-trifluoropropyl]hydrazine.
What is the SMILES notation for [1-(cycloocten-1-yl)-3,3,3-trifluoropropyl]hydrazine?
The canonical SMILES for [1-(cycloocten-1-yl)-3,3,3-trifluoropropyl]hydrazine is NNC(CC(F)(F)F)C1=CCCCCCC1.
What is the InChIKey of [1-(cycloocten-1-yl)-3,3,3-trifluoropropyl]hydrazine?
The InChIKey is UEBRAFKCPMKFNU-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H19F3N2/c12-11(13,14)8-10(16-15)9-6-4-2-1-3-5-7-9/h6,10,16H,1-5,7-8,15H2.
What are the key properties of [1-(cycloocten-1-yl)-3,3,3-trifluoropropyl]hydrazine?
[1-(cycloocten-1-yl)-3,3,3-trifluoropropyl]hydrazine has a molecular weight of 236.28 g/mol, XLogP of 3.05, 3 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for [1-(cycloocten-1-yl)-3,3,3-trifluoropropyl]hydrazine is sourced from PubChem (CID 106648704), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).