[1-(4,4-difluorocyclohexyl)-4-methoxybutyl]hydrazine

C11H22F2N2O — CID 105342561

IUPAC[1-(4,4-difluorocyclohexyl)-4-methoxybutyl]hydrazine
SMILESCOCCCC(NN)C1CCC(F)(F)CC1
InChIInChI=1S/C11H22F2N2O/c1-16-8-2-3-10(15-14)9-4-6-11(12,13)7-5-9/h9-10,15H,2-8,14H2,1H3
InChIKeyGTUXQNJOFOZVKO-UHFFFAOYSA-N
MW236.31 g/mol
LogP2.07
Rot. Bonds6

About [1-(4,4-difluorocyclohexyl)-4-methoxybutyl]hydrazine

[1-(4,4-difluorocyclohexyl)-4-methoxybutyl]hydrazine (PubChem CID 105342561) has the molecular formula C11H22F2N2O and a molecular weight of 236.31 g/mol. Its IUPAC name is [1-(4,4-difluorocyclohexyl)-4-methoxybutyl]hydrazine.

Molecular Properties

Compound Name[1-(4,4-difluorocyclohexyl)-4-methoxybutyl]hydrazine
PubChem CID105342561
Molecular FormulaC11H22F2N2O
Molecular Weight236.31 g/mol
Exact Mass236.17
IUPAC Name[1-(4,4-difluorocyclohexyl)-4-methoxybutyl]hydrazine
SMILESCOCCCC(NN)C1CCC(F)(F)CC1
InChIInChI=1S/C11H22F2N2O/c1-16-8-2-3-10(15-14)9-4-6-11(12,13)7-5-9/h9-10,15H,2-8,14H2,1H3
InChIKeyGTUXQNJOFOZVKO-UHFFFAOYSA-N
XLogP2.07
TPSA47.28 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds6
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500236.31
LogP ≤ 52.07
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
(1,1,1-Trifluoro-7-methoxy-7-methyloctan-4-yl)hydrazine
CID 103026297
[4-Methoxy-4-methyl-1-[3-(trifluoromethyl)cyclohexyl]pentyl]hydrazine
CID 103026334
[4-Methoxy-4-methyl-1-[2-(trifluoromethyl)cyclohexyl]pentyl]hydrazine
CID 103026395
[4-Methoxy-4-methyl-1-[4-(trifluoromethyl)cyclohexyl]pentyl]hydrazine
CID 103026483
[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-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
[5-Ethyl-1-(2,2,2-trifluoroethoxy)heptan-3-yl]hydrazine
CID 103151573

Frequently Asked Questions

What is the IUPAC name of [1-(4,4-difluorocyclohexyl)-4-methoxybutyl]hydrazine?
The IUPAC name of [1-(4,4-difluorocyclohexyl)-4-methoxybutyl]hydrazine (CID 105342561) is [1-(4,4-difluorocyclohexyl)-4-methoxybutyl]hydrazine.
What is the SMILES notation for [1-(4,4-difluorocyclohexyl)-4-methoxybutyl]hydrazine?
The canonical SMILES for [1-(4,4-difluorocyclohexyl)-4-methoxybutyl]hydrazine is COCCCC(NN)C1CCC(F)(F)CC1.
What is the InChIKey of [1-(4,4-difluorocyclohexyl)-4-methoxybutyl]hydrazine?
The InChIKey is GTUXQNJOFOZVKO-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H22F2N2O/c1-16-8-2-3-10(15-14)9-4-6-11(12,13)7-5-9/h9-10,15H,2-8,14H2,1H3.
What are the key properties of [1-(4,4-difluorocyclohexyl)-4-methoxybutyl]hydrazine?
[1-(4,4-difluorocyclohexyl)-4-methoxybutyl]hydrazine has a molecular weight of 236.31 g/mol, XLogP of 2.07, 6 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for [1-(4,4-difluorocyclohexyl)-4-methoxybutyl]hydrazine is sourced from PubChem (CID 105342561), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).