4,5,5,6,7,8,14,15-octamethylnonacyclo[8.6.0.01,12.02,7.02,9.03,6.03,16.04,15.013,16]hexadecane

C24H32 — CID 143863315

IUPAC4,5,5,6,7,8,14,15-octamethylnonacyclo[8.6.0.01,12.02,7.02,9.03,6.03,16.04,15.013,16]hexadecane
SMILESCC1C2C3CC4C5C(C)C6(C)C7(C)C(C)(C)C8(C)C1(C)C21C34C56C871
InChIInChI=1S/C24H32/c1-10-14-12-9-13-15-11(2)18(6)20(8)16(3,4)19(7)17(10,5)22(14)21(12,13)23(15,18)24(19,20)22/h10-15H,9H2,1-8H3
InChIKeyXPEZCZJJYQUKKO-UHFFFAOYSA-N
MW320.52 g/mol
LogP5.23
Rot. Bonds

About 4,5,5,6,7,8,14,15-octamethylnonacyclo[8.6.0.01,12.02,7.02,9.03,6.03,16.04,15.013,16]hexadecane

4,5,5,6,7,8,14,15-octamethylnonacyclo[8.6.0.01,12.02,7.02,9.03,6.03,16.04,15.013,16]hexadecane (PubChem CID 143863315) has the molecular formula C24H32 and a molecular weight of 320.52 g/mol. Its IUPAC name is 4,5,5,6,7,8,14,15-octamethylnonacyclo[8.6.0.01,12.02,7.02,9.03,6.03,16.04,15.013,16]hexadecane.

Molecular Properties

Compound Name4,5,5,6,7,8,14,15-octamethylnonacyclo[8.6.0.01,12.02,7.02,9.03,6.03,16.04,15.013,16]hexadecane
PubChem CID143863315
Molecular FormulaC24H32
Molecular Weight320.52 g/mol
Exact Mass320.25
IUPAC Name4,5,5,6,7,8,14,15-octamethylnonacyclo[8.6.0.01,12.02,7.02,9.03,6.03,16.04,15.013,16]hexadecane
SMILESCC1C2C3CC4C5C(C)C6(C)C7(C)C(C)(C)C8(C)C1(C)C21C34C56C871
InChIInChI=1S/C24H32/c1-10-14-12-9-13-15-11(2)18(6)20(8)16(3,4)19(7)17(10,5)22(14)21(12,13)23(15,18)24(19,20)22/h10-15H,9H2,1-8H3
InChIKeyXPEZCZJJYQUKKO-UHFFFAOYSA-N
XLogP5.23
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds
Heavy Atoms24
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500320.52
LogP ≤ 55.23
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 100

Analyze 4,5,5,6,7,8,14,15-octamethylnonacyclo[8.6.0.01,12.02,7.02,9.03,6.03,16.04,15.013,16]hexadecane with MolForge

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Related Compounds

1,2,2,3,4,5,6,7,8,9,10,22,23,24-tetradecamethyldotriacontacyclo[19.3.3.24,26.25,6.27,8.29,12.216,17.218,19.113,15.120,27.03,25.023,27.024,26.329,33.134,36.011,37.025,30.028,29.028,31.030,41.031,45.032,33.032,44.034,35.035,36.037,38.038,42.039,40.039,43.040,44.041,45.042,43]pentatetracontane
CID 59929066
1,2,33,34,35,36-hexamethylpentahexacontacyclo[30.4.4.34,39.26,7.28,9.210,11.212,13.217,18.221,22.223,24.225,26.227,28.229,30.114,16.131,40.03,37.034,40.035,39.036,38.449,52.342,47.343,64.360,62.248,63.258,59.15,65.153,55.019,54.037,44.038,43.041,42.041,45.044,66.045,84.046,47.046,83.048,49.050,51.050,80.051,79.052,53.054,55.056,57.056,76.057,58.059,60.061,62.061,73.063,64.065,68.066,69.067,70.067,82.068,83.069,84.070,72.071,81.071,82.072,81.073,80.074,75.074,79.075,78.076,77.077,78]tetraoctacontane
CID 58991895
1,2,20,21,22-pentamethyloctacosacyclo[17.3.3.24,24.26,7.28,11.214,15.216,17.118,25.03,23.021,25.022,24.35,30.131,33.010,34.012,32.023,28.026,27.026,29.027,39.028,40.029,39.030,31.032,33.034,35.035,37.036,38.036,40.037,38]tetracontane
CID 174084191
4,5,6-trimethyltridecacyclo[10.9.1.01,15.02,5.02,20.03,11.03,22.04,10.06,20.07,19.014,22.016,21.018,21]docosane
CID 174340867
7,8,9,10-tetramethyldodecacyclo[10.8.0.01,4.02,9.02,11.03,6.03,8.04,19.05,18.013,20.015,20.016,19]icosane
CID 20740891
(11S,12S,13R,14R,15R)-11,12,13,14,15-pentamethylnonadecacyclo[12.4.4.44,5.310,21.113,22.03,19.016,22.017,21.018,20.07,27.08,28.09,25.012,26.019,30.023,24.023,26.024,29.025,28.027,30]triacontane
CID 59097370
7,8,9-trimethylhenicosacyclo[11.4.4.44,5.29,20.110,11.112,21.03,18.06,10.015,21.016,20.017,19.07,26.08,27.018,29.019,28.022,23.022,25.023,28.024,25.024,27.026,29]nonacosane
CID 174062340
1,2,3,4,5,6,12,14,14-nonamethyl-3-propan-2-ylhexacyclo[6.6.0.02,7.04,13.05,11.09,13]tetradecane
CID 123841923
16,23,25-trimethylpentadecacyclo[7.6.6.46,16.07,21.010,20.011,19.012,18.013,17.015,17.03,22.04,24.018,22.019,23.020,24.021,25]pentacosane
CID 174061805
2,3,4,5,6,7,29,30,35,36-decamethylhentriacontacyclo[9.7.7.56,21.39,24.313,24.314,23.110,25.112,25.115,22.03,19.016,22.017,21.018,20.04,40.05,41.08,42.019,40.020,39.023,38.026,28.026,30.027,31.027,33.028,34.029,35.031,38.032,39.032,41.033,42.034,37.036,37]dotetracontane
CID 174082250
octatetracontacyclo[21.5.5.44,32.25,6.27,8.211,12.213,14.218,19.220,21.115,17.122,33.03,29.025,33.026,32.027,31.028,30.536,40.346,50.244,45.135,39.137,51.09,47.029,38.030,37.031,36.034,35.034,39.038,51.040,41.041,59.042,43.042,57.043,44.045,46.047,48.048,55.049,50.049,54.052,53.052,62.053,61.054,60.055,56.056,60.057,59.058,61.058,63.062,63]trihexacontane
CID 140616722
CID 59104663
CID 59104663

Frequently Asked Questions

What is the IUPAC name of 4,5,5,6,7,8,14,15-octamethylnonacyclo[8.6.0.01,12.02,7.02,9.03,6.03,16.04,15.013,16]hexadecane?
The IUPAC name of 4,5,5,6,7,8,14,15-octamethylnonacyclo[8.6.0.01,12.02,7.02,9.03,6.03,16.04,15.013,16]hexadecane (CID 143863315) is 4,5,5,6,7,8,14,15-octamethylnonacyclo[8.6.0.01,12.02,7.02,9.03,6.03,16.04,15.013,16]hexadecane.
What is the SMILES notation for 4,5,5,6,7,8,14,15-octamethylnonacyclo[8.6.0.01,12.02,7.02,9.03,6.03,16.04,15.013,16]hexadecane?
The canonical SMILES for 4,5,5,6,7,8,14,15-octamethylnonacyclo[8.6.0.01,12.02,7.02,9.03,6.03,16.04,15.013,16]hexadecane is CC1C2C3CC4C5C(C)C6(C)C7(C)C(C)(C)C8(C)C1(C)C21C34C56C871.
What is the InChIKey of 4,5,5,6,7,8,14,15-octamethylnonacyclo[8.6.0.01,12.02,7.02,9.03,6.03,16.04,15.013,16]hexadecane?
The InChIKey is XPEZCZJJYQUKKO-UHFFFAOYSA-N. The full InChI is InChI=1S/C24H32/c1-10-14-12-9-13-15-11(2)18(6)20(8)16(3,4)19(7)17(10,5)22(14)21(12,13)23(15,18)24(19,20)22/h10-15H,9H2,1-8H3.
What are the key properties of 4,5,5,6,7,8,14,15-octamethylnonacyclo[8.6.0.01,12.02,7.02,9.03,6.03,16.04,15.013,16]hexadecane?
4,5,5,6,7,8,14,15-octamethylnonacyclo[8.6.0.01,12.02,7.02,9.03,6.03,16.04,15.013,16]hexadecane has a molecular weight of 320.52 g/mol, XLogP of 5.23, 0 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for 4,5,5,6,7,8,14,15-octamethylnonacyclo[8.6.0.01,12.02,7.02,9.03,6.03,16.04,15.013,16]hexadecane is sourced from PubChem (CID 143863315), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).