5,5,8,8-tetramethylcyclodecyne

C14H24 — CID 519909

IUPAC5,5,8,8-tetramethylcyclodecyne
SMILESCC1(C)CCC#CCCC(C)(C)CC1
InChIInChI=1S/C14H24/c1-13(2)9-7-5-6-8-10-14(3,4)12-11-13/h7-12H2,1-4H3
InChIKeyAULNNULHCDQISI-UHFFFAOYSA-N
MW192.35 g/mol
LogP4.40
Rot. Bonds

About 5,5,8,8-tetramethylcyclodecyne

5,5,8,8-tetramethylcyclodecyne (PubChem CID 519909) has the molecular formula C14H24 and a molecular weight of 192.35 g/mol. Its IUPAC name is 5,5,8,8-tetramethylcyclodecyne.

Molecular Properties

Compound Name5,5,8,8-tetramethylcyclodecyne
PubChem CID519909
Molecular FormulaC14H24
Molecular Weight192.35 g/mol
Exact Mass192.19
IUPAC Name5,5,8,8-tetramethylcyclodecyne
SMILESCC1(C)CCC#CCCC(C)(C)CC1
InChIInChI=1S/C14H24/c1-13(2)9-7-5-6-8-10-14(3,4)12-11-13/h7-12H2,1-4H3
InChIKeyAULNNULHCDQISI-UHFFFAOYSA-N
XLogP4.40
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500192.35
LogP ≤ 54.40
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 100

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'triple_bond', 'substructure': 'N/A'}

Analyze 5,5,8,8-tetramethylcyclodecyne with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

1-Ethyl-1-ethynylcyclohexane
CID 21360967
Cycloheptyne,3,3,7,7-tetramethyl-
CID 141787
1,1,6,6-Tetramethyl-cyclodecan
CID 123578470
1,1,4,4-Tetramethylcyclodecane
CID 139981
1,1,5,5-Tetramethyl-cyclodecane
CID 140129
Cyclooctyne, 3,3,8,8-tetramethyl-
CID 143058
3-Ethyl-3-methylhept-1-yne
CID 12036480
Tetramethylde-cyne
CID 22267109
8,8-Dimethylnon-1-yne
CID 60061016
1-Hex-1-ynyl-1-methylcyclohexane
CID 85853507
6,10-Dimethyl-2-undecanine
CID 129870295
3-(2,2-Dimethylpropyl)-3-fluorocyclooctyne
CID 122674727

Frequently Asked Questions

What is the IUPAC name of 5,5,8,8-tetramethylcyclodecyne?
The IUPAC name of 5,5,8,8-tetramethylcyclodecyne (CID 519909) is 5,5,8,8-tetramethylcyclodecyne.
What is the SMILES notation for 5,5,8,8-tetramethylcyclodecyne?
The canonical SMILES for 5,5,8,8-tetramethylcyclodecyne is CC1(C)CCC#CCCC(C)(C)CC1.
What is the InChIKey of 5,5,8,8-tetramethylcyclodecyne?
The InChIKey is AULNNULHCDQISI-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H24/c1-13(2)9-7-5-6-8-10-14(3,4)12-11-13/h7-12H2,1-4H3.
What are the key properties of 5,5,8,8-tetramethylcyclodecyne?
5,5,8,8-tetramethylcyclodecyne has a molecular weight of 192.35 g/mol, XLogP of 4.40, 0 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for 5,5,8,8-tetramethylcyclodecyne is sourced from PubChem (CID 519909), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).