1-(4-butylcyclohexyl)but-3-ynylhydrazine

C14H26N2 — CID 105281413

IUPAC1-(4-butylcyclohexyl)but-3-ynylhydrazine
SMILESC#CCC(NN)C1CCC(CCCC)CC1
InChIInChI=1S/C14H26N2/c1-3-5-7-12-8-10-13(11-9-12)14(16-15)6-4-2/h2,12-14,16H,3,5-11,15H2,1H3
InChIKeyZZMNTKYCHAAQLY-UHFFFAOYSA-N
MW222.38 g/mol
LogP2.84
Rot. Bonds6

About 1-(4-butylcyclohexyl)but-3-ynylhydrazine

1-(4-butylcyclohexyl)but-3-ynylhydrazine (PubChem CID 105281413) has the molecular formula C14H26N2 and a molecular weight of 222.38 g/mol. Its IUPAC name is 1-(4-butylcyclohexyl)but-3-ynylhydrazine.

Molecular Properties

Compound Name1-(4-butylcyclohexyl)but-3-ynylhydrazine
PubChem CID105281413
Molecular FormulaC14H26N2
Molecular Weight222.38 g/mol
Exact Mass222.21
IUPAC Name1-(4-butylcyclohexyl)but-3-ynylhydrazine
SMILESC#CCC(NN)C1CCC(CCCC)CC1
InChIInChI=1S/C14H26N2/c1-3-5-7-12-8-10-13(11-9-12)14(16-15)6-4-2/h2,12-14,16H,3,5-11,15H2,1H3
InChIKeyZZMNTKYCHAAQLY-UHFFFAOYSA-N
XLogP2.84
TPSA38.05 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds6
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500222.38
LogP ≤ 52.84
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

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

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Related Compounds

[2-cyclopropyl-1-(4-propylcyclohexyl)ethyl]hydrazine
CID 105232141
1-(4-butylcyclohexyl)-N-methylhex-5-yn-1-amine
CID 105033925
1-(4-butylcyclohexyl)pent-4-yn-1-amine
CID 115859309
1-(4-ethylcyclohexyl)hex-5-ynylhydrazine
CID 105231468
1-(4-ethylcyclohexyl)pentylhydrazine
CID 105231359
1-(4-butylcyclohexyl)-N-ethylpropan-1-amine
CID 114979356
(4-butylcyclohexyl)-cyclopropylmethanamine
CID 104994185
1-cyclopropylpentylhydrazine
CID 105202332
[2-(2-bromophenyl)-1-(4-butylcyclohexyl)ethyl]hydrazine
CID 105283853
N-ethyl-1-(4-ethylcyclohexyl)but-3-yn-1-amine
CID 65394787
1-(4-butylcyclohexyl)pent-4-yn-1-ol
CID 115799427
1-cyclopropyl-N-methylbut-3-yn-1-amine
CID 62234254

Frequently Asked Questions

What is the IUPAC name of 1-(4-butylcyclohexyl)but-3-ynylhydrazine?
The IUPAC name of 1-(4-butylcyclohexyl)but-3-ynylhydrazine (CID 105281413) is 1-(4-butylcyclohexyl)but-3-ynylhydrazine.
What is the SMILES notation for 1-(4-butylcyclohexyl)but-3-ynylhydrazine?
The canonical SMILES for 1-(4-butylcyclohexyl)but-3-ynylhydrazine is C#CCC(NN)C1CCC(CCCC)CC1.
What is the InChIKey of 1-(4-butylcyclohexyl)but-3-ynylhydrazine?
The InChIKey is ZZMNTKYCHAAQLY-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H26N2/c1-3-5-7-12-8-10-13(11-9-12)14(16-15)6-4-2/h2,12-14,16H,3,5-11,15H2,1H3.
What are the key properties of 1-(4-butylcyclohexyl)but-3-ynylhydrazine?
1-(4-butylcyclohexyl)but-3-ynylhydrazine has a molecular weight of 222.38 g/mol, XLogP of 2.84, 6 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(4-butylcyclohexyl)but-3-ynylhydrazine is sourced from PubChem (CID 105281413), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).