1,1-dimethyl-2-[(4E)-7-pentylcyclooct-4-en-1-yl]hydrazine

C15H30N2 — CID 134266582

IUPAC1,1-dimethyl-2-[(4E)-7-pentylcyclooct-4-en-1-yl]hydrazine
SMILESCCCCCC1C/C=C\CCC(NN(C)C)C1
InChIInChI=1S/C15H30N2/c1-4-5-7-10-14-11-8-6-9-12-15(13-14)16-17(2)3/h6,8,14-16H,4-5,7,9-13H2,1-3H3/b8-6-
InChIKeyISYKIMANUHTZST-VURMDHGXSA-N
MW238.42 g/mol
LogP3.75
Rot. Bonds6

About 1,1-dimethyl-2-[(4E)-7-pentylcyclooct-4-en-1-yl]hydrazine

1,1-dimethyl-2-[(4E)-7-pentylcyclooct-4-en-1-yl]hydrazine (PubChem CID 134266582) has the molecular formula C15H30N2 and a molecular weight of 238.42 g/mol. Its IUPAC name is 1,1-dimethyl-2-[(4E)-7-pentylcyclooct-4-en-1-yl]hydrazine.

Molecular Properties

Compound Name1,1-dimethyl-2-[(4E)-7-pentylcyclooct-4-en-1-yl]hydrazine
PubChem CID134266582
Molecular FormulaC15H30N2
Molecular Weight238.42 g/mol
Exact Mass238.24
IUPAC Name1,1-dimethyl-2-[(4E)-7-pentylcyclooct-4-en-1-yl]hydrazine
SMILESCCCCCC1C/C=C\CCC(NN(C)C)C1
InChIInChI=1S/C15H30N2/c1-4-5-7-10-14-11-8-6-9-12-15(13-14)16-17(2)3/h6,8,14-16H,4-5,7,9-13H2,1-3H3/b8-6-
InChIKeyISYKIMANUHTZST-VURMDHGXSA-N
XLogP3.75
TPSA15.27 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds6
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500238.42
LogP ≤ 53.75
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Aliphatic_long_chain', '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 1,1-dimethyl-2-[(4E)-7-pentylcyclooct-4-en-1-yl]hydrazine?
The IUPAC name of 1,1-dimethyl-2-[(4E)-7-pentylcyclooct-4-en-1-yl]hydrazine (CID 134266582) is 1,1-dimethyl-2-[(4E)-7-pentylcyclooct-4-en-1-yl]hydrazine.
What is the SMILES notation for 1,1-dimethyl-2-[(4E)-7-pentylcyclooct-4-en-1-yl]hydrazine?
The canonical SMILES for 1,1-dimethyl-2-[(4E)-7-pentylcyclooct-4-en-1-yl]hydrazine is CCCCCC1C/C=C\CCC(NN(C)C)C1.
What is the InChIKey of 1,1-dimethyl-2-[(4E)-7-pentylcyclooct-4-en-1-yl]hydrazine?
The InChIKey is ISYKIMANUHTZST-VURMDHGXSA-N. The full InChI is InChI=1S/C15H30N2/c1-4-5-7-10-14-11-8-6-9-12-15(13-14)16-17(2)3/h6,8,14-16H,4-5,7,9-13H2,1-3H3/b8-6-.
What are the key properties of 1,1-dimethyl-2-[(4E)-7-pentylcyclooct-4-en-1-yl]hydrazine?
1,1-dimethyl-2-[(4E)-7-pentylcyclooct-4-en-1-yl]hydrazine has a molecular weight of 238.42 g/mol, XLogP of 3.75, 6 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 1,1-dimethyl-2-[(4E)-7-pentylcyclooct-4-en-1-yl]hydrazine is sourced from PubChem (CID 134266582), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).