2-(cycloocten-1-yl)-2-hydrazinyl-N,N-dimethylethanamine

C12H25N3 — CID 106649237

IUPAC2-(cycloocten-1-yl)-2-hydrazinyl-N,N-dimethylethanamine
SMILESCN(C)CC(NN)C1=CCCCCCC1
InChIInChI=1S/C12H25N3/c1-15(2)10-12(14-13)11-8-6-4-3-5-7-9-11/h8,12,14H,3-7,9-10,13H2,1-2H3
InChIKeyQAIXJFZROZBGJL-UHFFFAOYSA-N
MW211.35 g/mol
LogP1.66
Rot. Bonds4

About 2-(cycloocten-1-yl)-2-hydrazinyl-N,N-dimethylethanamine

2-(cycloocten-1-yl)-2-hydrazinyl-N,N-dimethylethanamine (PubChem CID 106649237) has the molecular formula C12H25N3 and a molecular weight of 211.35 g/mol. Its IUPAC name is 2-(cycloocten-1-yl)-2-hydrazinyl-N,N-dimethylethanamine.

Molecular Properties

Compound Name2-(cycloocten-1-yl)-2-hydrazinyl-N,N-dimethylethanamine
PubChem CID106649237
Molecular FormulaC12H25N3
Molecular Weight211.35 g/mol
Exact Mass211.20
IUPAC Name2-(cycloocten-1-yl)-2-hydrazinyl-N,N-dimethylethanamine
SMILESCN(C)CC(NN)C1=CCCCCCC1
InChIInChI=1S/C12H25N3/c1-15(2)10-12(14-13)11-8-6-4-3-5-7-9-11/h8,12,14H,3-7,9-10,13H2,1-2H3
InChIKeyQAIXJFZROZBGJL-UHFFFAOYSA-N
XLogP1.66
TPSA41.29 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms15
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500211.35
LogP ≤ 51.66
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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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Frequently Asked Questions

What is the IUPAC name of 2-(cycloocten-1-yl)-2-hydrazinyl-N,N-dimethylethanamine?
The IUPAC name of 2-(cycloocten-1-yl)-2-hydrazinyl-N,N-dimethylethanamine (CID 106649237) is 2-(cycloocten-1-yl)-2-hydrazinyl-N,N-dimethylethanamine.
What is the SMILES notation for 2-(cycloocten-1-yl)-2-hydrazinyl-N,N-dimethylethanamine?
The canonical SMILES for 2-(cycloocten-1-yl)-2-hydrazinyl-N,N-dimethylethanamine is CN(C)CC(NN)C1=CCCCCCC1.
What is the InChIKey of 2-(cycloocten-1-yl)-2-hydrazinyl-N,N-dimethylethanamine?
The InChIKey is QAIXJFZROZBGJL-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H25N3/c1-15(2)10-12(14-13)11-8-6-4-3-5-7-9-11/h8,12,14H,3-7,9-10,13H2,1-2H3.
What are the key properties of 2-(cycloocten-1-yl)-2-hydrazinyl-N,N-dimethylethanamine?
2-(cycloocten-1-yl)-2-hydrazinyl-N,N-dimethylethanamine has a molecular weight of 211.35 g/mol, XLogP of 1.66, 4 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(cycloocten-1-yl)-2-hydrazinyl-N,N-dimethylethanamine is sourced from PubChem (CID 106649237), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).