[1-(cyclohepten-1-yl)-2-(3,5-difluorophenyl)ethyl]hydrazine

C15H20F2N2 — CID 106648713

IUPAC[1-(cyclohepten-1-yl)-2-(3,5-difluorophenyl)ethyl]hydrazine
SMILESNNC(Cc1cc(F)cc(F)c1)C1=CCCCCC1
InChIInChI=1S/C15H20F2N2/c16-13-7-11(8-14(17)10-13)9-15(19-18)12-5-3-1-2-4-6-12/h5,7-8,10,15,19H,1-4,6,9,18H2
InChIKeyGYRAXOYECQYFAD-UHFFFAOYSA-N
MW266.33 g/mol
LogP3.23
Rot. Bonds4

About [1-(cyclohepten-1-yl)-2-(3,5-difluorophenyl)ethyl]hydrazine

[1-(cyclohepten-1-yl)-2-(3,5-difluorophenyl)ethyl]hydrazine (PubChem CID 106648713) has the molecular formula C15H20F2N2 and a molecular weight of 266.33 g/mol. Its IUPAC name is [1-(cyclohepten-1-yl)-2-(3,5-difluorophenyl)ethyl]hydrazine.

Molecular Properties

Compound Name[1-(cyclohepten-1-yl)-2-(3,5-difluorophenyl)ethyl]hydrazine
PubChem CID106648713
Molecular FormulaC15H20F2N2
Molecular Weight266.33 g/mol
Exact Mass266.16
IUPAC Name[1-(cyclohepten-1-yl)-2-(3,5-difluorophenyl)ethyl]hydrazine
SMILESNNC(Cc1cc(F)cc(F)c1)C1=CCCCCC1
InChIInChI=1S/C15H20F2N2/c16-13-7-11(8-14(17)10-13)9-15(19-18)12-5-3-1-2-4-6-12/h5,7-8,10,15,19H,1-4,6,9,18H2
InChIKeyGYRAXOYECQYFAD-UHFFFAOYSA-N
XLogP3.23
TPSA38.05 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500266.33
LogP ≤ 53.23
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'hydrazine', 'substructure': 'N/A'}, {'alert_name': 'isolated_alkene', 'substructure': 'N/A'}, {'alert_name': 'Oxygen-nitrogen_single_bond', 'substructure': 'N/A'}

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Related Compounds

[1-[(1E)-cycloocten-1-yl]-2-(3,5-difluorophenyl)ethyl]hydrazine
CID 106648712
[2-(4-bromophenyl)-1-(cyclohepten-1-yl)ethyl]hydrazine
CID 106648573
[2-(4-chlorophenyl)-1-[(1E)-cycloocten-1-yl]ethyl]hydrazine
CID 106648598
[1-(cyclohexen-1-yl)-2-(2-fluorophenyl)ethyl]hydrazine
CID 106648715
[1-(cyclohexen-1-yl)-2-thiophen-3-ylethyl]hydrazine
CID 106650433
[1-(cyclohexen-1-yl)-2-(3-methoxyphenyl)ethyl]hydrazine
CID 106648692
[1-(cyclohepten-1-yl)-3-methylbutyl]hydrazine
CID 106648613
1-(cyclohexen-1-yl)-2-(4-fluorophenyl)-N-methylethanamine
CID 62079036
[1-[(1E)-cycloocten-1-yl]-2-(2,6-dichlorophenyl)ethyl]hydrazine
CID 106648752
2-(cycloocten-1-yl)-2-hydrazinyl-N,N-dimethylethanamine
CID 106649237
[1-(cyclohepten-1-yl)-2-cycloheptylethyl]hydrazine
CID 106650401
cyclohepten-1-yl-(3,5-difluorophenyl)methanamine
CID 62080192

Frequently Asked Questions

What is the IUPAC name of [1-(cyclohepten-1-yl)-2-(3,5-difluorophenyl)ethyl]hydrazine?
The IUPAC name of [1-(cyclohepten-1-yl)-2-(3,5-difluorophenyl)ethyl]hydrazine (CID 106648713) is [1-(cyclohepten-1-yl)-2-(3,5-difluorophenyl)ethyl]hydrazine.
What is the SMILES notation for [1-(cyclohepten-1-yl)-2-(3,5-difluorophenyl)ethyl]hydrazine?
The canonical SMILES for [1-(cyclohepten-1-yl)-2-(3,5-difluorophenyl)ethyl]hydrazine is NNC(Cc1cc(F)cc(F)c1)C1=CCCCCC1.
What is the InChIKey of [1-(cyclohepten-1-yl)-2-(3,5-difluorophenyl)ethyl]hydrazine?
The InChIKey is GYRAXOYECQYFAD-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H20F2N2/c16-13-7-11(8-14(17)10-13)9-15(19-18)12-5-3-1-2-4-6-12/h5,7-8,10,15,19H,1-4,6,9,18H2.
What are the key properties of [1-(cyclohepten-1-yl)-2-(3,5-difluorophenyl)ethyl]hydrazine?
[1-(cyclohepten-1-yl)-2-(3,5-difluorophenyl)ethyl]hydrazine has a molecular weight of 266.33 g/mol, XLogP of 3.23, 4 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for [1-(cyclohepten-1-yl)-2-(3,5-difluorophenyl)ethyl]hydrazine is sourced from PubChem (CID 106648713), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).