14,19-dimethyl-8-methylidenepentacyclo[11.8.0.02,10.05,10.014,19]henicosane

C24H38 — CID 142981628

IUPAC14,19-dimethyl-8-methylidenepentacyclo[11.8.0.02,10.05,10.014,19]henicosane
SMILESC=C1CCC2CCC3C4CCC5(C)CCCCC5(C)C4CCC23C1
InChIInChI=1S/C24H38/c1-17-6-7-18-8-9-21-19-10-14-22(2)12-4-5-13-23(22,3)20(19)11-15-24(18,21)16-17/h18-21H,1,4-16H2,2-3H3
InChIKeyZHQWLNQJZIEEJJ-UHFFFAOYSA-N
MW326.57 g/mol
LogP7.15
Rot. Bonds

About 14,19-dimethyl-8-methylidenepentacyclo[11.8.0.02,10.05,10.014,19]henicosane

14,19-dimethyl-8-methylidenepentacyclo[11.8.0.02,10.05,10.014,19]henicosane (PubChem CID 142981628) has the molecular formula C24H38 and a molecular weight of 326.57 g/mol. Its IUPAC name is 14,19-dimethyl-8-methylidenepentacyclo[11.8.0.02,10.05,10.014,19]henicosane.

Molecular Properties

Compound Name14,19-dimethyl-8-methylidenepentacyclo[11.8.0.02,10.05,10.014,19]henicosane
PubChem CID142981628
Molecular FormulaC24H38
Molecular Weight326.57 g/mol
Exact Mass326.30
IUPAC Name14,19-dimethyl-8-methylidenepentacyclo[11.8.0.02,10.05,10.014,19]henicosane
SMILESC=C1CCC2CCC3C4CCC5(C)CCCCC5(C)C4CCC23C1
InChIInChI=1S/C24H38/c1-17-6-7-18-8-9-21-19-10-14-22(2)12-4-5-13-23(22,3)20(19)11-15-24(18,21)16-17/h18-21H,1,4-16H2,2-3H3
InChIKeyZHQWLNQJZIEEJJ-UHFFFAOYSA-N
XLogP7.15
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds
Heavy Atoms24
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500326.57
LogP ≤ 57.15
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 100

Computed Properties (RDKit)

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

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Related Compounds

acetylene;14,19-dimethyl-8-methylidenepentacyclo[11.8.0.02,10.05,10.014,19]henicosane;ethane
CID 142981627
5,10,13,17-tetramethyl-1,2,3,4,6,7,8,9,11,12,14,15,16,17-tetradecahydrocyclopenta[a]phenanthrene
CID 143398911
ethane;17-ethyl-5,10,13-trimethyl-1,2,3,4,6,7,8,9,11,12,14,15,16,17-tetradecahydrocyclopenta[a]phenanthrene
CID 145177952
10,13,17-trimethyl-2-methylidene-3,4,5,6,7,8,9,11,12,14,15,16-dodecahydro-1H-cyclopenta[a]phenanthren-17-ol
CID 3780537
(1S)-1-[(5S,8R,9R,10R,13S,14S,17S)-5,10,13-trimethyl-2-methylidene-3,4,6,7,8,9,11,12,14,15,16,17-dodecahydro-1H-cyclopenta[a]phenanthren-17-yl]ethanol
CID 11890571
[(14R,17R,19R)-17-hydroxy-14-methyl-8-oxo-19-pentacyclo[11.8.0.02,10.05,10.014,19]henicosanyl]-methylidyneazanium
CID 148852800
2-[2-(5,10,13-trimethyl-1,2,3,4,6,7,8,9,11,12,14,15,16,17-tetradecahydrocyclopenta[a]phenanthren-17-yl)ethyl]propanedioic acid
CID 145414556
(1R,2S,5S,13S,14S)-14-methylpentacyclo[11.8.0.02,10.05,10.014,19]henicosane
CID 173088711
(5S,10R,14S)-14-methylpentacyclo[11.8.0.02,10.05,10.014,19]henicosane
CID 142981610
5-but-3-enyl-10,13-dimethyl-17-methylidene-2,3,4,6,7,8,9,11,12,14,15,16-dodecahydro-1H-cyclopenta[a]phenanthrene
CID 91008308
(4R)-4-[(5S,10R,13R)-5,10,13-trimethyl-1,2,3,4,6,7,8,9,11,12,14,15,16,17-tetradecahydrocyclopenta[a]phenanthren-17-yl]pentanoic acid
CID 143398918
[2-[(5R,8S,9R,10R,13R,14S,17R)-17-hydroxy-5,10,13-trimethyl-2,3,4,6,7,8,9,11,12,14,15,16-dodecahydro-1H-cyclopenta[a]phenanthren-17-yl]-2-oxoethyl] acetate
CID 11890305

Frequently Asked Questions

What is the IUPAC name of 14,19-dimethyl-8-methylidenepentacyclo[11.8.0.02,10.05,10.014,19]henicosane?
The IUPAC name of 14,19-dimethyl-8-methylidenepentacyclo[11.8.0.02,10.05,10.014,19]henicosane (CID 142981628) is 14,19-dimethyl-8-methylidenepentacyclo[11.8.0.02,10.05,10.014,19]henicosane.
What is the SMILES notation for 14,19-dimethyl-8-methylidenepentacyclo[11.8.0.02,10.05,10.014,19]henicosane?
The canonical SMILES for 14,19-dimethyl-8-methylidenepentacyclo[11.8.0.02,10.05,10.014,19]henicosane is C=C1CCC2CCC3C4CCC5(C)CCCCC5(C)C4CCC23C1.
What is the InChIKey of 14,19-dimethyl-8-methylidenepentacyclo[11.8.0.02,10.05,10.014,19]henicosane?
The InChIKey is ZHQWLNQJZIEEJJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C24H38/c1-17-6-7-18-8-9-21-19-10-14-22(2)12-4-5-13-23(22,3)20(19)11-15-24(18,21)16-17/h18-21H,1,4-16H2,2-3H3.
What are the key properties of 14,19-dimethyl-8-methylidenepentacyclo[11.8.0.02,10.05,10.014,19]henicosane?
14,19-dimethyl-8-methylidenepentacyclo[11.8.0.02,10.05,10.014,19]henicosane has a molecular weight of 326.57 g/mol, XLogP of 7.15, 0 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for 14,19-dimethyl-8-methylidenepentacyclo[11.8.0.02,10.05,10.014,19]henicosane is sourced from PubChem (CID 142981628), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).