[2-(3,3-difluorocyclohexyl)-1-(2,5-dimethylfuran-3-yl)ethyl]hydrazine

C14H22F2N2O — CID 114226056

IUPAC[2-(3,3-difluorocyclohexyl)-1-(2,5-dimethylfuran-3-yl)ethyl]hydrazine
SMILESCc1cc(C(CC2CCCC(F)(F)C2)NN)c(C)o1
InChIInChI=1S/C14H22F2N2O/c1-9-6-12(10(2)19-9)13(18-17)7-11-4-3-5-14(15,16)8-11/h6,11,13,18H,3-5,7-8,17H2,1-2H3
InChIKeyCBGXCHXLPHXFDP-UHFFFAOYSA-N
MW272.34 g/mol
LogP3.62
Rot. Bonds4

About [2-(3,3-difluorocyclohexyl)-1-(2,5-dimethylfuran-3-yl)ethyl]hydrazine

[2-(3,3-difluorocyclohexyl)-1-(2,5-dimethylfuran-3-yl)ethyl]hydrazine (PubChem CID 114226056) has the molecular formula C14H22F2N2O and a molecular weight of 272.34 g/mol. Its IUPAC name is [2-(3,3-difluorocyclohexyl)-1-(2,5-dimethylfuran-3-yl)ethyl]hydrazine.

Molecular Properties

Compound Name[2-(3,3-difluorocyclohexyl)-1-(2,5-dimethylfuran-3-yl)ethyl]hydrazine
PubChem CID114226056
Molecular FormulaC14H22F2N2O
Molecular Weight272.34 g/mol
Exact Mass272.17
IUPAC Name[2-(3,3-difluorocyclohexyl)-1-(2,5-dimethylfuran-3-yl)ethyl]hydrazine
SMILESCc1cc(C(CC2CCCC(F)(F)C2)NN)c(C)o1
InChIInChI=1S/C14H22F2N2O/c1-9-6-12(10(2)19-9)13(18-17)7-11-4-3-5-14(15,16)8-11/h6,11,13,18H,3-5,7-8,17H2,1-2H3
InChIKeyCBGXCHXLPHXFDP-UHFFFAOYSA-N
XLogP3.62
TPSA51.19 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500272.34
LogP ≤ 53.62
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

[2-cyclobutyl-1-(2,5-dimethylfuran-3-yl)ethyl]hydrazine
CID 105310050
5-chloro-2-[2-(3,3-difluorocyclohexyl)-1-hydrazinylethyl]aniline
CID 114225965
[2-(3,3-difluorocyclohexyl)-1-(3-methoxyphenyl)ethyl]hydrazine
CID 114225939
[2-(3,3-difluorocyclopentyl)-1-(3,4-dimethylphenyl)ethyl]hydrazine
CID 114226042
2-(3,3-difluorocyclohexyl)-N-methyl-1-(4-methylthiophen-3-yl)ethanamine
CID 114224891
[1-(2,5-dibromophenyl)-2-(3,3-difluorocyclopentyl)ethyl]hydrazine
CID 114226017
5-chloro-2-[2-(3,3-difluorocyclopentyl)-1-hydrazinylethyl]aniline
CID 114225964
[cycloheptyl-(2,5-dimethylfuran-3-yl)methyl]hydrazine
CID 105330649
3-(2-chlorobutyl)-1,1-difluorocyclohexane
CID 126974576
3-(2-chloro-3-methylbutyl)-1,1-difluorocyclohexane
CID 130487710
4-(3,3-difluorocyclohexyl)-2,3-dimethyl-N-propan-2-ylbutan-1-amine
CID 114225502
N-(cyclopropylmethyl)-1-(2,5-dimethylfuran-3-yl)ethanamine
CID 43121203

Frequently Asked Questions

What is the IUPAC name of [2-(3,3-difluorocyclohexyl)-1-(2,5-dimethylfuran-3-yl)ethyl]hydrazine?
The IUPAC name of [2-(3,3-difluorocyclohexyl)-1-(2,5-dimethylfuran-3-yl)ethyl]hydrazine (CID 114226056) is [2-(3,3-difluorocyclohexyl)-1-(2,5-dimethylfuran-3-yl)ethyl]hydrazine.
What is the SMILES notation for [2-(3,3-difluorocyclohexyl)-1-(2,5-dimethylfuran-3-yl)ethyl]hydrazine?
The canonical SMILES for [2-(3,3-difluorocyclohexyl)-1-(2,5-dimethylfuran-3-yl)ethyl]hydrazine is Cc1cc(C(CC2CCCC(F)(F)C2)NN)c(C)o1.
What is the InChIKey of [2-(3,3-difluorocyclohexyl)-1-(2,5-dimethylfuran-3-yl)ethyl]hydrazine?
The InChIKey is CBGXCHXLPHXFDP-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H22F2N2O/c1-9-6-12(10(2)19-9)13(18-17)7-11-4-3-5-14(15,16)8-11/h6,11,13,18H,3-5,7-8,17H2,1-2H3.
What are the key properties of [2-(3,3-difluorocyclohexyl)-1-(2,5-dimethylfuran-3-yl)ethyl]hydrazine?
[2-(3,3-difluorocyclohexyl)-1-(2,5-dimethylfuran-3-yl)ethyl]hydrazine has a molecular weight of 272.34 g/mol, XLogP of 3.62, 4 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for [2-(3,3-difluorocyclohexyl)-1-(2,5-dimethylfuran-3-yl)ethyl]hydrazine is sourced from PubChem (CID 114226056), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).