[7-bicyclo[4.1.0]heptanyl-[4-(trifluoromethyl)phenyl]methyl]hydrazine

C15H19F3N2 — CID 105302349

IUPAC[7-bicyclo[4.1.0]heptanyl-[4-(trifluoromethyl)phenyl]methyl]hydrazine
SMILESNNC(c1ccc(C(F)(F)F)cc1)C1C2CCCCC21
InChIInChI=1S/C15H19F3N2/c16-15(17,18)10-7-5-9(6-8-10)14(20-19)13-11-3-1-2-4-12(11)13/h5-8,11-14,20H,1-4,19H2
InChIKeyBXIDVAVNWQTDHM-UHFFFAOYSA-N
MW284.32 g/mol
LogP3.65
Rot. Bonds3

About [7-bicyclo[4.1.0]heptanyl-[4-(trifluoromethyl)phenyl]methyl]hydrazine

[7-bicyclo[4.1.0]heptanyl-[4-(trifluoromethyl)phenyl]methyl]hydrazine (PubChem CID 105302349) has the molecular formula C15H19F3N2 and a molecular weight of 284.32 g/mol. Its IUPAC name is [7-bicyclo[4.1.0]heptanyl-[4-(trifluoromethyl)phenyl]methyl]hydrazine.

Molecular Properties

Compound Name[7-bicyclo[4.1.0]heptanyl-[4-(trifluoromethyl)phenyl]methyl]hydrazine
PubChem CID105302349
Molecular FormulaC15H19F3N2
Molecular Weight284.32 g/mol
Exact Mass284.15
IUPAC Name[7-bicyclo[4.1.0]heptanyl-[4-(trifluoromethyl)phenyl]methyl]hydrazine
SMILESNNC(c1ccc(C(F)(F)F)cc1)C1C2CCCCC21
InChIInChI=1S/C15H19F3N2/c16-15(17,18)10-7-5-9(6-8-10)14(20-19)13-11-3-1-2-4-12(11)13/h5-8,11-14,20H,1-4,19H2
InChIKeyBXIDVAVNWQTDHM-UHFFFAOYSA-N
XLogP3.65
TPSA38.05 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500284.32
LogP ≤ 53.65
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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

[7-bicyclo[4.1.0]heptanyl-(3,4-difluorophenyl)methyl]hydrazine
CID 105304990
[1-(7-bicyclo[4.1.0]heptanyl)-2-[4-(trifluoromethyl)phenyl]ethyl]hydrazine
CID 105299705
[7-bicyclo[4.1.0]heptanyl(pyrimidin-5-yl)methyl]hydrazine
CID 105292201
[6-bicyclo[3.1.0]hexanyl-(3,4-dimethylphenyl)methyl]hydrazine
CID 105300274
[7-bicyclo[4.1.0]heptanyl-(5-methylthiophen-3-yl)methyl]hydrazine
CID 105313323
[7-bicyclo[4.1.0]heptanyl-(1-methylpyrazol-4-yl)methyl]hydrazine
CID 105288758
N'-cyclopentyl-1-[4-(trifluoromethyl)phenyl]ethane-1,2-diamine
CID 117244514
2-(cyclobutylmethylamino)-1-[4-(trifluoromethyl)phenyl]ethanol
CID 60901206
[cyclobutyl-[3-(trifluoromethyl)phenyl]methyl]hydrazine
CID 105193958
(1S,2R)-2-amino-1-cyclohexyl-2-[4-(trifluoromethyl)phenyl]ethanol
CID 171160385
(R)-cyclopentyl-[4-[4-(trifluoromethyl)phenyl]phenyl]methanamine;hydrochloride
CID 171211545
cyclooctyl-[4-(trifluoromethyl)phenyl]methanol
CID 80603410

Frequently Asked Questions

What is the IUPAC name of [7-bicyclo[4.1.0]heptanyl-[4-(trifluoromethyl)phenyl]methyl]hydrazine?
The IUPAC name of [7-bicyclo[4.1.0]heptanyl-[4-(trifluoromethyl)phenyl]methyl]hydrazine (CID 105302349) is [7-bicyclo[4.1.0]heptanyl-[4-(trifluoromethyl)phenyl]methyl]hydrazine.
What is the SMILES notation for [7-bicyclo[4.1.0]heptanyl-[4-(trifluoromethyl)phenyl]methyl]hydrazine?
The canonical SMILES for [7-bicyclo[4.1.0]heptanyl-[4-(trifluoromethyl)phenyl]methyl]hydrazine is NNC(c1ccc(C(F)(F)F)cc1)C1C2CCCCC21.
What is the InChIKey of [7-bicyclo[4.1.0]heptanyl-[4-(trifluoromethyl)phenyl]methyl]hydrazine?
The InChIKey is BXIDVAVNWQTDHM-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H19F3N2/c16-15(17,18)10-7-5-9(6-8-10)14(20-19)13-11-3-1-2-4-12(11)13/h5-8,11-14,20H,1-4,19H2.
What are the key properties of [7-bicyclo[4.1.0]heptanyl-[4-(trifluoromethyl)phenyl]methyl]hydrazine?
[7-bicyclo[4.1.0]heptanyl-[4-(trifluoromethyl)phenyl]methyl]hydrazine has a molecular weight of 284.32 g/mol, XLogP of 3.65, 3 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for [7-bicyclo[4.1.0]heptanyl-[4-(trifluoromethyl)phenyl]methyl]hydrazine is sourced from PubChem (CID 105302349), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).