10,14-dimethyl-7,15-dimethylidenepentacyclo[9.7.0.02,4.05,10.014,18]octadecane

C22H32 — CID 123606397

IUPAC10,14-dimethyl-7,15-dimethylidenepentacyclo[9.7.0.02,4.05,10.014,18]octadecane
SMILESC=C1CCC2(C)C(C1)C1CC1C1C3CCC(=C)C3(C)CCC12
InChIInChI=1S/C22H32/c1-13-7-9-22(4)18-8-10-21(3)14(2)5-6-17(21)20(18)16-12-15(16)19(22)11-13/h15-20H,1-2,5-12H2,3-4H3
InChIKeySGKIQWTTYILKBT-UHFFFAOYSA-N
MW296.50 g/mol
LogP6.00
Rot. Bonds

About 10,14-dimethyl-7,15-dimethylidenepentacyclo[9.7.0.02,4.05,10.014,18]octadecane

10,14-dimethyl-7,15-dimethylidenepentacyclo[9.7.0.02,4.05,10.014,18]octadecane (PubChem CID 123606397) has the molecular formula C22H32 and a molecular weight of 296.50 g/mol. Its IUPAC name is 10,14-dimethyl-7,15-dimethylidenepentacyclo[9.7.0.02,4.05,10.014,18]octadecane.

Molecular Properties

Compound Name10,14-dimethyl-7,15-dimethylidenepentacyclo[9.7.0.02,4.05,10.014,18]octadecane
PubChem CID123606397
Molecular FormulaC22H32
Molecular Weight296.50 g/mol
Exact Mass296.25
IUPAC Name10,14-dimethyl-7,15-dimethylidenepentacyclo[9.7.0.02,4.05,10.014,18]octadecane
SMILESC=C1CCC2(C)C(C1)C1CC1C1C3CCC(=C)C3(C)CCC12
InChIInChI=1S/C22H32/c1-13-7-9-22(4)18-8-10-21(3)14(2)5-6-17(21)20(18)16-12-15(16)19(22)11-13/h15-20H,1-2,5-12H2,3-4H3
InChIKeySGKIQWTTYILKBT-UHFFFAOYSA-N
XLogP6.00
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds
Heavy Atoms22
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500296.50
LogP ≤ 56.00
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

(3S,5S,6R,7R,8R,9S,10R,13S,14S)-10,13-dimethyl-17-methylidene-1,2,3,4,5,6,7,8,9,11,12,14,15,16-tetradecahydrocyclopenta[a]phenanthrene-3,6,7-triol
CID 130227125
(6R)-4,4,12,16-tetramethyl-17-methylidene-3,5-dioxapentacyclo[11.7.0.02,6.07,12.016,20]icosan-9-ol
CID 129044813
[(3S,6R,10R,13S)-6,7-dihydroxy-10,13-dimethyl-17-methylidene-1,2,3,4,5,6,7,8,9,11,12,14,15,16-tetradecahydrocyclopenta[a]phenanthren-3-yl] acetate
CID 160621845
(5S,8S,9R,10S,13R,14R)-10,13-dimethyl-3,6-dimethylidene-1,2,4,5,7,8,9,11,12,14,15,16-dodecahydrocyclopenta[a]phenanthren-17-one
CID 118580249
6-ethyl-10,13-dimethyl-17-methylidene-1,2,3,4,5,6,7,8,9,11,12,14,15,16-tetradecahydrocyclopenta[a]phenanthrene
CID 91057403
7a-methyl-1-methylidene-3,3a,4,5,6,7-hexahydro-2H-inden-4-ol
CID 143095782
(5S,8R,9S,10S,13S,14S)-10,13-dimethyl-17-methylidene-1,2,3,4,5,6,7,8,9,11,12,14,15,16-tetradecahydrocyclopenta[a]phenanthrene
CID 173324612
(2S,3S,5S,8R,9S,10S,13S,14S)-2,10,13-trimethyl-17-methylidene-1,2,3,4,5,6,7,8,9,11,12,14,15,16-tetradecahydrocyclopenta[a]phenanthren-3-ol
CID 90379457
(3S,10R,13S)-3,10,13-trimethyl-17-methylidene-1,2,3,6,7,8,9,11,12,14,15,16-dodecahydrocyclopenta[a]phenanthrene
CID 59116721
(3R,10R,13S)-10,13-dimethyl-17-methylidene-1,2,3,6,7,8,9,11,12,14,15,16-dodecahydrocyclopenta[a]phenanthren-3-ol
CID 59916980
2,6,13,13,21-pentamethyl-20-methylidene-12,14-dioxa-5-thia-7-azahexacyclo[14.7.0.02,10.04,8.011,15.017,21]tricosa-4(8),6-diene
CID 123733947
(8R,9R,10S,13S,14S)-7,10,13-trimethyl-2,4,5,6,7,8,9,11,12,14,15,16-dodecahydro-1H-cyclopenta[a]phenanthrene-3,17-dione
CID 69009514

Frequently Asked Questions

What is the IUPAC name of 10,14-dimethyl-7,15-dimethylidenepentacyclo[9.7.0.02,4.05,10.014,18]octadecane?
The IUPAC name of 10,14-dimethyl-7,15-dimethylidenepentacyclo[9.7.0.02,4.05,10.014,18]octadecane (CID 123606397) is 10,14-dimethyl-7,15-dimethylidenepentacyclo[9.7.0.02,4.05,10.014,18]octadecane.
What is the SMILES notation for 10,14-dimethyl-7,15-dimethylidenepentacyclo[9.7.0.02,4.05,10.014,18]octadecane?
The canonical SMILES for 10,14-dimethyl-7,15-dimethylidenepentacyclo[9.7.0.02,4.05,10.014,18]octadecane is C=C1CCC2(C)C(C1)C1CC1C1C3CCC(=C)C3(C)CCC12.
What is the InChIKey of 10,14-dimethyl-7,15-dimethylidenepentacyclo[9.7.0.02,4.05,10.014,18]octadecane?
The InChIKey is SGKIQWTTYILKBT-UHFFFAOYSA-N. The full InChI is InChI=1S/C22H32/c1-13-7-9-22(4)18-8-10-21(3)14(2)5-6-17(21)20(18)16-12-15(16)19(22)11-13/h15-20H,1-2,5-12H2,3-4H3.
What are the key properties of 10,14-dimethyl-7,15-dimethylidenepentacyclo[9.7.0.02,4.05,10.014,18]octadecane?
10,14-dimethyl-7,15-dimethylidenepentacyclo[9.7.0.02,4.05,10.014,18]octadecane has a molecular weight of 296.50 g/mol, XLogP of 6.00, 0 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for 10,14-dimethyl-7,15-dimethylidenepentacyclo[9.7.0.02,4.05,10.014,18]octadecane is sourced from PubChem (CID 123606397), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).