heptacyclo[14.7.1.02,14.03,11.04,8.05,23.020,24]tetracosane

C24H36 — CID 91257687

IUPACheptacyclo[14.7.1.02,14.03,11.04,8.05,23.020,24]tetracosane
SMILESC1CC2CCC3C4CCC5CCC6CCC7CC(C1)C2C3C7C6C54
InChIInChI=1S/C24H36/c1-2-13-8-11-19-18-10-9-14-4-5-15-6-7-17-12-16(3-1)20(13)24(19)23(17)22(15)21(14)18/h13-24H,1-12H2
InChIKeyCXMZJUDEZILUCH-UHFFFAOYSA-N
MW324.55 g/mol
LogP6.16
Rot. Bonds

About heptacyclo[14.7.1.02,14.03,11.04,8.05,23.020,24]tetracosane

heptacyclo[14.7.1.02,14.03,11.04,8.05,23.020,24]tetracosane (PubChem CID 91257687) has the molecular formula C24H36 and a molecular weight of 324.55 g/mol. Its IUPAC name is heptacyclo[14.7.1.02,14.03,11.04,8.05,23.020,24]tetracosane.

Molecular Properties

Compound Nameheptacyclo[14.7.1.02,14.03,11.04,8.05,23.020,24]tetracosane
PubChem CID91257687
Molecular FormulaC24H36
Molecular Weight324.55 g/mol
Exact Mass324.28
IUPAC Nameheptacyclo[14.7.1.02,14.03,11.04,8.05,23.020,24]tetracosane
SMILESC1CC2CCC3C4CCC5CCC6CCC7CC(C1)C2C3C7C6C54
InChIInChI=1S/C24H36/c1-2-13-8-11-19-18-10-9-14-4-5-15-6-7-17-12-16(3-1)20(13)24(19)23(17)22(15)21(14)18/h13-24H,1-12H2
InChIKeyCXMZJUDEZILUCH-UHFFFAOYSA-N
XLogP6.16
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds
Heavy Atoms24
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500324.55
LogP ≤ 56.16
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 100

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Related Compounds

hexadecacyclo[22.22.2.03,8.07,12.09,47.010,23.011,20.014,19.018,31.021,30.022,27.025,42.026,39.028,37.029,34.044,48]octatetracontane
CID 140677748
tricosacyclo[27.9.7.79,25.710,20.46,42.228,44.05,39.033,45.035,43.037,41.146,48.014,65.016,63.018,61.024,59.040,50.047,52.049,56.051,58.053,60.054,66.055,62.057,64]hexahexacontane
CID 139213160
octacyclo[17.7.1.04,25.07,24.010,23.013,22.015,20.021,26]heptacosane
CID 101255308
pentacyclo[13.3.1.05,18.08,17.011,16]nonadecane
CID 59725363
tetracyclo[10.2.1.05,14.08,13]pentadecane
CID 13164121
nonacyclo[20.6.2.02,6.07,27.010,26.013,25.014,18.019,24.023,28]triacontane
CID 91087023
nonacyclo[17.2.0.02,5.03,21.04,7.06,9.08,11.010,13.012,15]henicosane
CID 20700610
tetracyclo[6.5.2.04,15.011,14]pentadecane
CID 91584207
(8aS)-1,2,3,3a,4,5,5a,6,7,8,8a,9,10,10a,10b,10c-hexadecahydropyrene
CID 143216402
nonadecacyclo[27.23.1.14,44.06,43.09,42.011,40.014,39.016,37.019,36.021,34.024,33.026,31.030,51.032,49.035,48.038,47.041,46.045,50.052,54]tetrapentacontane
CID 101083105
2-[2-(1,2,3,4,4a,5,6,7,8,8a-decahydronaphthalen-2-yl)cyclohexyl]-1,2,3,3a,4,5,5a,6,7,8,8a,9,10,10a,10b,10c-hexadecahydropyrene
CID 164666249
(3R,5R,8S,12R,17S,19S,22S,23S,24R,29S,32R)-dodecacyclo[15.13.1.13,26.05,25.08,24.010,22.012,21.014,19.018,29.020,28.023,27.030,32]dotriacontane
CID 58820692

Frequently Asked Questions

What is the IUPAC name of heptacyclo[14.7.1.02,14.03,11.04,8.05,23.020,24]tetracosane?
The IUPAC name of heptacyclo[14.7.1.02,14.03,11.04,8.05,23.020,24]tetracosane (CID 91257687) is heptacyclo[14.7.1.02,14.03,11.04,8.05,23.020,24]tetracosane.
What is the SMILES notation for heptacyclo[14.7.1.02,14.03,11.04,8.05,23.020,24]tetracosane?
The canonical SMILES for heptacyclo[14.7.1.02,14.03,11.04,8.05,23.020,24]tetracosane is C1CC2CCC3C4CCC5CCC6CCC7CC(C1)C2C3C7C6C54.
What is the InChIKey of heptacyclo[14.7.1.02,14.03,11.04,8.05,23.020,24]tetracosane?
The InChIKey is CXMZJUDEZILUCH-UHFFFAOYSA-N. The full InChI is InChI=1S/C24H36/c1-2-13-8-11-19-18-10-9-14-4-5-15-6-7-17-12-16(3-1)20(13)24(19)23(17)22(15)21(14)18/h13-24H,1-12H2.
What are the key properties of heptacyclo[14.7.1.02,14.03,11.04,8.05,23.020,24]tetracosane?
heptacyclo[14.7.1.02,14.03,11.04,8.05,23.020,24]tetracosane has a molecular weight of 324.55 g/mol, XLogP of 6.16, 0 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for heptacyclo[14.7.1.02,14.03,11.04,8.05,23.020,24]tetracosane is sourced from PubChem (CID 91257687), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).