[2-bicyclo[2.2.1]heptanyl(cycloocten-1-yl)methyl]hydrazine

C16H28N2 — CID 106649507

IUPAC[2-bicyclo[2.2.1]heptanyl(cycloocten-1-yl)methyl]hydrazine
SMILESNNC(C1=CCCCCCC1)C1CC2CCC1C2
InChIInChI=1S/C16H28N2/c17-18-16(13-6-4-2-1-3-5-7-13)15-11-12-8-9-14(15)10-12/h6,12,14-16,18H,1-5,7-11,17H2
InChIKeyONLOAKXYSJBDSG-UHFFFAOYSA-N
MW248.41 g/mol
LogP3.54
Rot. Bonds3

About [2-bicyclo[2.2.1]heptanyl(cycloocten-1-yl)methyl]hydrazine

[2-bicyclo[2.2.1]heptanyl(cycloocten-1-yl)methyl]hydrazine (PubChem CID 106649507) has the molecular formula C16H28N2 and a molecular weight of 248.41 g/mol. Its IUPAC name is [2-bicyclo[2.2.1]heptanyl(cycloocten-1-yl)methyl]hydrazine.

Molecular Properties

Compound Name[2-bicyclo[2.2.1]heptanyl(cycloocten-1-yl)methyl]hydrazine
PubChem CID106649507
Molecular FormulaC16H28N2
Molecular Weight248.41 g/mol
Exact Mass248.23
IUPAC Name[2-bicyclo[2.2.1]heptanyl(cycloocten-1-yl)methyl]hydrazine
SMILESNNC(C1=CCCCCCC1)C1CC2CCC1C2
InChIInChI=1S/C16H28N2/c17-18-16(13-6-4-2-1-3-5-7-13)15-11-12-8-9-14(15)10-12/h6,12,14-16,18H,1-5,7-11,17H2
InChIKeyONLOAKXYSJBDSG-UHFFFAOYSA-N
XLogP3.54
TPSA38.05 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500248.41
LogP ≤ 53.54
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

2-bicyclo[2.2.1]heptanyl(cycloocten-1-yl)methanol
CID 106657571
[cyclohepten-1-yl-(2-methylcyclopentyl)methyl]hydrazine
CID 107195085
[cyclohexen-1-yl-(2-methylcyclopentyl)methyl]hydrazine
CID 107195089
[3-bicyclo[3.1.0]hexanyl(cyclohepten-1-yl)methyl]hydrazine
CID 106650217
[cycloocten-1-yl-(3-methylcyclopentyl)methyl]hydrazine
CID 106649073
1-(2-adamantyl)-1-(cyclohepten-1-yl)-N-methylmethanamine
CID 81099133
[cyclohexen-1-yl-(2-methyloxolan-3-yl)methyl]hydrazine
CID 106650596
[cyclohepten-1-yl-(2,2-dimethylcyclopropyl)methyl]hydrazine
CID 107005912
[cyclohexen-1-yl(oxan-3-yl)methyl]hydrazine
CID 106649029
[cyclohepten-1-yl-(3-ethylcyclopentyl)methyl]hydrazine
CID 106649078
[[(1E)-cycloocten-1-yl]-(2,3-dihydro-1H-inden-2-yl)methyl]hydrazine
CID 106649088
2-(2-bicyclo[2.2.1]heptanyl)-1-(cyclohexen-1-yl)-N-methylethanamine
CID 63504992

Frequently Asked Questions

What is the IUPAC name of [2-bicyclo[2.2.1]heptanyl(cycloocten-1-yl)methyl]hydrazine?
The IUPAC name of [2-bicyclo[2.2.1]heptanyl(cycloocten-1-yl)methyl]hydrazine (CID 106649507) is [2-bicyclo[2.2.1]heptanyl(cycloocten-1-yl)methyl]hydrazine.
What is the SMILES notation for [2-bicyclo[2.2.1]heptanyl(cycloocten-1-yl)methyl]hydrazine?
The canonical SMILES for [2-bicyclo[2.2.1]heptanyl(cycloocten-1-yl)methyl]hydrazine is NNC(C1=CCCCCCC1)C1CC2CCC1C2.
What is the InChIKey of [2-bicyclo[2.2.1]heptanyl(cycloocten-1-yl)methyl]hydrazine?
The InChIKey is ONLOAKXYSJBDSG-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H28N2/c17-18-16(13-6-4-2-1-3-5-7-13)15-11-12-8-9-14(15)10-12/h6,12,14-16,18H,1-5,7-11,17H2.
What are the key properties of [2-bicyclo[2.2.1]heptanyl(cycloocten-1-yl)methyl]hydrazine?
[2-bicyclo[2.2.1]heptanyl(cycloocten-1-yl)methyl]hydrazine has a molecular weight of 248.41 g/mol, XLogP of 3.54, 3 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for [2-bicyclo[2.2.1]heptanyl(cycloocten-1-yl)methyl]hydrazine is sourced from PubChem (CID 106649507), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).