[1-(2-ethylcyclohexyl)-3-(2,2,2-trifluoroethoxy)propyl]hydrazine

C13H25F3N2O — CID 103151644

IUPAC[1-(2-ethylcyclohexyl)-3-(2,2,2-trifluoroethoxy)propyl]hydrazine
SMILESCCC1CCCCC1C(CCOCC(F)(F)F)NN
InChIInChI=1S/C13H25F3N2O/c1-2-10-5-3-4-6-11(10)12(18-17)7-8-19-9-13(14,15)16/h10-12,18H,2-9,17H2,1H3
InChIKeyDTCTYOFNYIZRLU-UHFFFAOYSA-N
MW282.35 g/mol
LogP3.00
Rot. Bonds7

About [1-(2-ethylcyclohexyl)-3-(2,2,2-trifluoroethoxy)propyl]hydrazine

[1-(2-ethylcyclohexyl)-3-(2,2,2-trifluoroethoxy)propyl]hydrazine (PubChem CID 103151644) has the molecular formula C13H25F3N2O and a molecular weight of 282.35 g/mol. Its IUPAC name is [1-(2-ethylcyclohexyl)-3-(2,2,2-trifluoroethoxy)propyl]hydrazine.

Molecular Properties

Compound Name[1-(2-ethylcyclohexyl)-3-(2,2,2-trifluoroethoxy)propyl]hydrazine
PubChem CID103151644
Molecular FormulaC13H25F3N2O
Molecular Weight282.35 g/mol
Exact Mass282.19
IUPAC Name[1-(2-ethylcyclohexyl)-3-(2,2,2-trifluoroethoxy)propyl]hydrazine
SMILESCCC1CCCCC1C(CCOCC(F)(F)F)NN
InChIInChI=1S/C13H25F3N2O/c1-2-10-5-3-4-6-11(10)12(18-17)7-8-19-9-13(14,15)16/h10-12,18H,2-9,17H2,1H3
InChIKeyDTCTYOFNYIZRLU-UHFFFAOYSA-N
XLogP3.00
TPSA47.28 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds7
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500282.35
LogP ≤ 53.00
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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Related Compounds

[1-(4,4-Difluorocyclohexyl)-4-methoxy-4-methylpentyl]hydrazine
CID 103026280
[4-Methoxy-4-methyl-1-[2-(trifluoromethyl)cyclohexyl]pentyl]hydrazine
CID 103026395
[1-Cycloheptyl-3-(2,2,2-trifluoroethoxy)propyl]hydrazine
CID 103151444
[7-Methyl-1-(2,2,2-trifluoroethoxy)octan-3-yl]hydrazine
CID 103151446
[5-Methyl-1-(2,2,2-trifluoroethoxy)heptan-3-yl]hydrazine
CID 103151447
[1-Cyclopropyl-4-(2,2,2-trifluoroethoxy)butan-2-yl]hydrazine
CID 103151457
[5-Methyl-1-(2,2,2-trifluoroethoxy)hexan-3-yl]hydrazine
CID 103151460
[1-Cyclobutyl-3-(2,2,2-trifluoroethoxy)propyl]hydrazine
CID 103151497
[1-Cyclobutyl-4-(2,2,2-trifluoroethoxy)butan-2-yl]hydrazine
CID 103151501
[1-Cyclopentyl-4-(2,2,2-trifluoroethoxy)butan-2-yl]hydrazine
CID 103151504
[5-Ethyl-1-(2,2,2-trifluoroethoxy)nonan-3-yl]hydrazine
CID 103151536
[1-Cyclohexyl-4-(2,2,2-trifluoroethoxy)butan-2-yl]hydrazine
CID 103151539

Frequently Asked Questions

What is the IUPAC name of [1-(2-ethylcyclohexyl)-3-(2,2,2-trifluoroethoxy)propyl]hydrazine?
The IUPAC name of [1-(2-ethylcyclohexyl)-3-(2,2,2-trifluoroethoxy)propyl]hydrazine (CID 103151644) is [1-(2-ethylcyclohexyl)-3-(2,2,2-trifluoroethoxy)propyl]hydrazine.
What is the SMILES notation for [1-(2-ethylcyclohexyl)-3-(2,2,2-trifluoroethoxy)propyl]hydrazine?
The canonical SMILES for [1-(2-ethylcyclohexyl)-3-(2,2,2-trifluoroethoxy)propyl]hydrazine is CCC1CCCCC1C(CCOCC(F)(F)F)NN.
What is the InChIKey of [1-(2-ethylcyclohexyl)-3-(2,2,2-trifluoroethoxy)propyl]hydrazine?
The InChIKey is DTCTYOFNYIZRLU-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H25F3N2O/c1-2-10-5-3-4-6-11(10)12(18-17)7-8-19-9-13(14,15)16/h10-12,18H,2-9,17H2,1H3.
What are the key properties of [1-(2-ethylcyclohexyl)-3-(2,2,2-trifluoroethoxy)propyl]hydrazine?
[1-(2-ethylcyclohexyl)-3-(2,2,2-trifluoroethoxy)propyl]hydrazine has a molecular weight of 282.35 g/mol, XLogP of 3.00, 7 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for [1-(2-ethylcyclohexyl)-3-(2,2,2-trifluoroethoxy)propyl]hydrazine is sourced from PubChem (CID 103151644), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).