[1-(3,3-difluorocyclohexyl)-4-(oxolan-2-yl)butyl]hydrazine

C14H26F2N2O — CID 114216924

IUPAC[1-(3,3-difluorocyclohexyl)-4-(oxolan-2-yl)butyl]hydrazine
SMILESNNC(CCCC1CCCO1)C1CCCC(F)(F)C1
InChIInChI=1S/C14H26F2N2O/c15-14(16)8-2-4-11(10-14)13(18-17)7-1-5-12-6-3-9-19-12/h11-13,18H,1-10,17H2
InChIKeyVQMDPWBUTKYCIS-UHFFFAOYSA-N
MW276.37 g/mol
LogP2.99
Rot. Bonds6

About [1-(3,3-difluorocyclohexyl)-4-(oxolan-2-yl)butyl]hydrazine

[1-(3,3-difluorocyclohexyl)-4-(oxolan-2-yl)butyl]hydrazine (PubChem CID 114216924) has the molecular formula C14H26F2N2O and a molecular weight of 276.37 g/mol. Its IUPAC name is [1-(3,3-difluorocyclohexyl)-4-(oxolan-2-yl)butyl]hydrazine.

Molecular Properties

Compound Name[1-(3,3-difluorocyclohexyl)-4-(oxolan-2-yl)butyl]hydrazine
PubChem CID114216924
Molecular FormulaC14H26F2N2O
Molecular Weight276.37 g/mol
Exact Mass276.20
IUPAC Name[1-(3,3-difluorocyclohexyl)-4-(oxolan-2-yl)butyl]hydrazine
SMILESNNC(CCCC1CCCO1)C1CCCC(F)(F)C1
InChIInChI=1S/C14H26F2N2O/c15-14(16)8-2-4-11(10-14)13(18-17)7-1-5-12-6-3-9-19-12/h11-13,18H,1-10,17H2
InChIKeyVQMDPWBUTKYCIS-UHFFFAOYSA-N
XLogP2.99
TPSA47.28 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds6
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500276.37
LogP ≤ 52.99
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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Related Compounds

[1-Cyclohexyl-4-(2,2,2-trifluoroethoxy)butan-2-yl]hydrazine
CID 103151539
[1-Cyclohexyl-3-(2,2,2-trifluoroethoxy)propyl]hydrazine
CID 103151608
[1-(4-Methylcyclohexyl)-3-(2,2,2-trifluoroethoxy)propyl]hydrazine
CID 103151626
[1-(3,5-Dimethylcyclohexyl)-3-(2,2,2-trifluoroethoxy)propyl]hydrazine
CID 103151627
[1-(3-Methylcyclohexyl)-3-(2,2,2-trifluoroethoxy)propyl]hydrazine
CID 103151669
[1-(4-Ethylcyclohexyl)-3-(2,2,2-trifluoroethoxy)propyl]hydrazine
CID 103151714
[1-(3-Ethylcyclohexyl)-3-(2,2,2-trifluoroethoxy)propyl]hydrazine
CID 103151738
[1-Cyclohexyl-4-(2,2-difluoroethoxy)butan-2-yl]hydrazine
CID 103151861
[1-Cyclohexyl-3-(2,2-difluoroethoxy)propyl]hydrazine
CID 103151930
[3-(2,2-Difluoroethoxy)-1-(4-methylcyclohexyl)propyl]hydrazine
CID 103151950
[3-(2,2-Difluoroethoxy)-1-(3,5-dimethylcyclohexyl)propyl]hydrazine
CID 103151951
[3-(2,2-Difluoroethoxy)-1-(3-methylcyclohexyl)propyl]hydrazine
CID 103152005

Frequently Asked Questions

What is the IUPAC name of [1-(3,3-difluorocyclohexyl)-4-(oxolan-2-yl)butyl]hydrazine?
The IUPAC name of [1-(3,3-difluorocyclohexyl)-4-(oxolan-2-yl)butyl]hydrazine (CID 114216924) is [1-(3,3-difluorocyclohexyl)-4-(oxolan-2-yl)butyl]hydrazine.
What is the SMILES notation for [1-(3,3-difluorocyclohexyl)-4-(oxolan-2-yl)butyl]hydrazine?
The canonical SMILES for [1-(3,3-difluorocyclohexyl)-4-(oxolan-2-yl)butyl]hydrazine is NNC(CCCC1CCCO1)C1CCCC(F)(F)C1.
What is the InChIKey of [1-(3,3-difluorocyclohexyl)-4-(oxolan-2-yl)butyl]hydrazine?
The InChIKey is VQMDPWBUTKYCIS-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H26F2N2O/c15-14(16)8-2-4-11(10-14)13(18-17)7-1-5-12-6-3-9-19-12/h11-13,18H,1-10,17H2.
What are the key properties of [1-(3,3-difluorocyclohexyl)-4-(oxolan-2-yl)butyl]hydrazine?
[1-(3,3-difluorocyclohexyl)-4-(oxolan-2-yl)butyl]hydrazine has a molecular weight of 276.37 g/mol, XLogP of 2.99, 6 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for [1-(3,3-difluorocyclohexyl)-4-(oxolan-2-yl)butyl]hydrazine is sourced from PubChem (CID 114216924), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).