[cyclohepten-1-yl-[4-(trifluoromethyl)cyclohexyl]methyl]hydrazine

C15H25F3N2 — CID 106650308

IUPAC[cyclohepten-1-yl-[4-(trifluoromethyl)cyclohexyl]methyl]hydrazine
SMILESNNC(C1=CCCCCC1)C1CCC(C(F)(F)F)CC1
InChIInChI=1S/C15H25F3N2/c16-15(17,18)13-9-7-12(8-10-13)14(20-19)11-5-3-1-2-4-6-11/h5,12-14,20H,1-4,6-10,19H2
InChIKeyAQAHDMROMFTMOV-UHFFFAOYSA-N
MW290.37 g/mol
LogP4.08
Rot. Bonds3

About [cyclohepten-1-yl-[4-(trifluoromethyl)cyclohexyl]methyl]hydrazine

[cyclohepten-1-yl-[4-(trifluoromethyl)cyclohexyl]methyl]hydrazine (PubChem CID 106650308) has the molecular formula C15H25F3N2 and a molecular weight of 290.37 g/mol. Its IUPAC name is [cyclohepten-1-yl-[4-(trifluoromethyl)cyclohexyl]methyl]hydrazine.

Molecular Properties

Compound Name[cyclohepten-1-yl-[4-(trifluoromethyl)cyclohexyl]methyl]hydrazine
PubChem CID106650308
Molecular FormulaC15H25F3N2
Molecular Weight290.37 g/mol
Exact Mass290.20
IUPAC Name[cyclohepten-1-yl-[4-(trifluoromethyl)cyclohexyl]methyl]hydrazine
SMILESNNC(C1=CCCCCC1)C1CCC(C(F)(F)F)CC1
InChIInChI=1S/C15H25F3N2/c16-15(17,18)13-9-7-12(8-10-13)14(20-19)11-5-3-1-2-4-6-11/h5,12-14,20H,1-4,6-10,19H2
InChIKeyAQAHDMROMFTMOV-UHFFFAOYSA-N
XLogP4.08
TPSA38.05 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500290.37
LogP ≤ 54.08
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

3-Methyl-1-[4-(trifluoromethyl)cyclohexyl]but-2-en-1-amine
CID 105163485
[1-(Cyclohexen-1-yl)-5,5,5-trifluoropentan-2-yl]hydrazine
CID 105269859
[1-(Cyclohexen-1-yl)-6,6,6-trifluorohexan-2-yl]hydrazine
CID 105269964
1-[3-(Trifluoromethyl)cyclohexyl]but-3-enylhydrazine
CID 105289643
1-(4,4-Difluorocyclohexyl)but-3-enylhydrazine
CID 105289648
1-[4-(Trifluoromethyl)cyclohexyl]but-3-enylhydrazine
CID 105289665
1-[3-(Trifluoromethyl)cyclohexyl]hex-5-enylhydrazine
CID 105311347
1-(4,4-Difluorocyclohexyl)hex-5-enylhydrazine
CID 105311352
1-[4-(Trifluoromethyl)cyclohexyl]hex-5-enylhydrazine
CID 105311377
1-[3-(Trifluoromethyl)cyclohexyl]pent-4-enylhydrazine
CID 105311607
1-(4,4-Difluorocyclohexyl)pent-4-enylhydrazine
CID 105311612
1-[4-(Trifluoromethyl)cyclohexyl]pent-4-enylhydrazine
CID 105311638

Frequently Asked Questions

What is the IUPAC name of [cyclohepten-1-yl-[4-(trifluoromethyl)cyclohexyl]methyl]hydrazine?
The IUPAC name of [cyclohepten-1-yl-[4-(trifluoromethyl)cyclohexyl]methyl]hydrazine (CID 106650308) is [cyclohepten-1-yl-[4-(trifluoromethyl)cyclohexyl]methyl]hydrazine.
What is the SMILES notation for [cyclohepten-1-yl-[4-(trifluoromethyl)cyclohexyl]methyl]hydrazine?
The canonical SMILES for [cyclohepten-1-yl-[4-(trifluoromethyl)cyclohexyl]methyl]hydrazine is NNC(C1=CCCCCC1)C1CCC(C(F)(F)F)CC1.
What is the InChIKey of [cyclohepten-1-yl-[4-(trifluoromethyl)cyclohexyl]methyl]hydrazine?
The InChIKey is AQAHDMROMFTMOV-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H25F3N2/c16-15(17,18)13-9-7-12(8-10-13)14(20-19)11-5-3-1-2-4-6-11/h5,12-14,20H,1-4,6-10,19H2.
What are the key properties of [cyclohepten-1-yl-[4-(trifluoromethyl)cyclohexyl]methyl]hydrazine?
[cyclohepten-1-yl-[4-(trifluoromethyl)cyclohexyl]methyl]hydrazine has a molecular weight of 290.37 g/mol, XLogP of 4.08, 3 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for [cyclohepten-1-yl-[4-(trifluoromethyl)cyclohexyl]methyl]hydrazine is sourced from PubChem (CID 106650308), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).