[cycloheptyl-(2,3-difluorophenyl)methyl]hydrazine

C14H20F2N2 — CID 105231971

IUPAC[cycloheptyl-(2,3-difluorophenyl)methyl]hydrazine
SMILESNNC(c1cccc(F)c1F)C1CCCCCC1
InChIInChI=1S/C14H20F2N2/c15-12-9-5-8-11(13(12)16)14(18-17)10-6-3-1-2-4-7-10/h5,8-10,14,18H,1-4,6-7,17H2
InChIKeyYJZUXCRFQIIBES-UHFFFAOYSA-N
MW254.32 g/mol
LogP3.44
Rot. Bonds3

About [cycloheptyl-(2,3-difluorophenyl)methyl]hydrazine

[cycloheptyl-(2,3-difluorophenyl)methyl]hydrazine (PubChem CID 105231971) has the molecular formula C14H20F2N2 and a molecular weight of 254.32 g/mol. Its IUPAC name is [cycloheptyl-(2,3-difluorophenyl)methyl]hydrazine.

Molecular Properties

Compound Name[cycloheptyl-(2,3-difluorophenyl)methyl]hydrazine
PubChem CID105231971
Molecular FormulaC14H20F2N2
Molecular Weight254.32 g/mol
Exact Mass254.16
IUPAC Name[cycloheptyl-(2,3-difluorophenyl)methyl]hydrazine
SMILESNNC(c1cccc(F)c1F)C1CCCCCC1
InChIInChI=1S/C14H20F2N2/c15-12-9-5-8-11(13(12)16)14(18-17)10-6-3-1-2-4-7-10/h5,8-10,14,18H,1-4,6-7,17H2
InChIKeyYJZUXCRFQIIBES-UHFFFAOYSA-N
XLogP3.44
TPSA38.05 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms18
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500254.32
LogP ≤ 53.44
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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Frequently Asked Questions

What is the IUPAC name of [cycloheptyl-(2,3-difluorophenyl)methyl]hydrazine?
The IUPAC name of [cycloheptyl-(2,3-difluorophenyl)methyl]hydrazine (CID 105231971) is [cycloheptyl-(2,3-difluorophenyl)methyl]hydrazine.
What is the SMILES notation for [cycloheptyl-(2,3-difluorophenyl)methyl]hydrazine?
The canonical SMILES for [cycloheptyl-(2,3-difluorophenyl)methyl]hydrazine is NNC(c1cccc(F)c1F)C1CCCCCC1.
What is the InChIKey of [cycloheptyl-(2,3-difluorophenyl)methyl]hydrazine?
The InChIKey is YJZUXCRFQIIBES-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H20F2N2/c15-12-9-5-8-11(13(12)16)14(18-17)10-6-3-1-2-4-7-10/h5,8-10,14,18H,1-4,6-7,17H2.
What are the key properties of [cycloheptyl-(2,3-difluorophenyl)methyl]hydrazine?
[cycloheptyl-(2,3-difluorophenyl)methyl]hydrazine has a molecular weight of 254.32 g/mol, XLogP of 3.44, 3 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for [cycloheptyl-(2,3-difluorophenyl)methyl]hydrazine is sourced from PubChem (CID 105231971), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).