heptadecacyclo[16.14.1.02,17.03,16.04,15.05,14.06,13.07,12.08,11.019,22.020,32.020,33.021,24.021,31.023,26.024,30.025,29]tritriacontane

C33H34 — CID 59762676

IUPACheptadecacyclo[16.14.1.02,17.03,16.04,15.05,14.06,13.07,12.08,11.019,22.020,32.020,33.021,24.021,31.023,26.024,30.025,29]tritriacontane
SMILESC1CC2C1C1C2C2C1C1C2C2C1C1C2C2C1C1C3C2C2C4C5C6CCC7C6C56C7C5C1C32C546
InChIInChI=1S/C33H34/c1-2-6-5(1)9-10(6)12-11(9)13-14(12)16-15(13)17-18(16)20-19(17)21-26-22(20)28-30-25-8-4-3-7-23(8)31(25)24(7)29-27(21)32(26,28)33(29,30)31/h5-30H,1-4H2
InChIKeyIKKHIMFJTGNXAV-UHFFFAOYSA-N
MW430.64 g/mol
LogP4.76
Rot. Bonds

About heptadecacyclo[16.14.1.02,17.03,16.04,15.05,14.06,13.07,12.08,11.019,22.020,32.020,33.021,24.021,31.023,26.024,30.025,29]tritriacontane

heptadecacyclo[16.14.1.02,17.03,16.04,15.05,14.06,13.07,12.08,11.019,22.020,32.020,33.021,24.021,31.023,26.024,30.025,29]tritriacontane (PubChem CID 59762676) has the molecular formula C33H34 and a molecular weight of 430.64 g/mol. Its IUPAC name is heptadecacyclo[16.14.1.02,17.03,16.04,15.05,14.06,13.07,12.08,11.019,22.020,32.020,33.021,24.021,31.023,26.024,30.025,29]tritriacontane.

Molecular Properties

Compound Nameheptadecacyclo[16.14.1.02,17.03,16.04,15.05,14.06,13.07,12.08,11.019,22.020,32.020,33.021,24.021,31.023,26.024,30.025,29]tritriacontane
PubChem CID59762676
Molecular FormulaC33H34
Molecular Weight430.64 g/mol
Exact Mass430.27
IUPAC Nameheptadecacyclo[16.14.1.02,17.03,16.04,15.05,14.06,13.07,12.08,11.019,22.020,32.020,33.021,24.021,31.023,26.024,30.025,29]tritriacontane
SMILESC1CC2C1C1C2C2C1C1C2C2C1C1C2C2C1C1C3C2C2C4C5C6CCC7C6C56C7C5C1C32C546
InChIInChI=1S/C33H34/c1-2-6-5(1)9-10(6)12-11(9)13-14(12)16-15(13)17-18(16)20-19(17)21-26-22(20)28-30-25-8-4-3-7-23(8)31(25)24(7)29-27(21)32(26,28)33(29,30)31/h5-30H,1-4H2
InChIKeyIKKHIMFJTGNXAV-UHFFFAOYSA-N
XLogP4.76
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds
Heavy Atoms33
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500430.64
LogP ≤ 54.76
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 100

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'cyclooctane_1', 'substructure': 'N/A'}

Analyze heptadecacyclo[16.14.1.02,17.03,16.04,15.05,14.06,13.07,12.08,11.019,22.020,32.020,33.021,24.021,31.023,26.024,30.025,29]tritriacontane 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

CID 59762681
CID 59762681
(12S)-octacyclo[8.8.0.02,9.03,8.04,7.011,18.012,17.013,16]octadecane
CID 59762682
heptadecacyclo[18.16.0.02,19.03,18.04,17.05,16.06,15.07,14.08,13.09,12.021,36.022,35.023,34.024,33.025,32.026,31.027,30]hexatriacontane
CID 20663352
ethane;hexacyclo[6.6.0.02,7.03,6.09,14.010,13]tetradecane
CID 160503054
pentacyclo[4.4.0.02,8.03,5.04,7]decane
CID 90487238
tetracyclo[4.4.0.02,7.03,8]decane
CID 146782655
(3R,6R,7S,10S)-tetracyclo[5.3.0.02,6.03,10]decane
CID 124525163
octacyclo[10.8.0.02,11.03,10.04,9.05,8.014,19.015,18]icosane
CID 54326568
19,20-dimethylnonadecacyclo[36.2.0.02,37.03,36.04,35.05,34.06,33.07,32.08,31.09,30.010,29.011,28.012,27.013,26.014,25.015,24.016,23.017,22.018,21]tetracontane
CID 59256890
17,18-dimethyloctadecacyclo[32.4.0.02,33.03,32.04,31.05,30.06,29.07,28.08,27.09,26.010,25.011,24.012,23.013,22.014,21.015,20.016,19.035,38]octatriacontane
CID 59256891
pentacyclo[6.4.0.02,7.03,6.09,12]dodecan-3-amine
CID 174360020
octacyclo[10.6.2.02,11.03,10.04,9.05,8.013,18.014,17]icos-19-yne
CID 174103055

Frequently Asked Questions

What is the IUPAC name of heptadecacyclo[16.14.1.02,17.03,16.04,15.05,14.06,13.07,12.08,11.019,22.020,32.020,33.021,24.021,31.023,26.024,30.025,29]tritriacontane?
The IUPAC name of heptadecacyclo[16.14.1.02,17.03,16.04,15.05,14.06,13.07,12.08,11.019,22.020,32.020,33.021,24.021,31.023,26.024,30.025,29]tritriacontane (CID 59762676) is heptadecacyclo[16.14.1.02,17.03,16.04,15.05,14.06,13.07,12.08,11.019,22.020,32.020,33.021,24.021,31.023,26.024,30.025,29]tritriacontane.
What is the SMILES notation for heptadecacyclo[16.14.1.02,17.03,16.04,15.05,14.06,13.07,12.08,11.019,22.020,32.020,33.021,24.021,31.023,26.024,30.025,29]tritriacontane?
The canonical SMILES for heptadecacyclo[16.14.1.02,17.03,16.04,15.05,14.06,13.07,12.08,11.019,22.020,32.020,33.021,24.021,31.023,26.024,30.025,29]tritriacontane is C1CC2C1C1C2C2C1C1C2C2C1C1C2C2C1C1C3C2C2C4C5C6CCC7C6C56C7C5C1C32C546.
What is the InChIKey of heptadecacyclo[16.14.1.02,17.03,16.04,15.05,14.06,13.07,12.08,11.019,22.020,32.020,33.021,24.021,31.023,26.024,30.025,29]tritriacontane?
The InChIKey is IKKHIMFJTGNXAV-UHFFFAOYSA-N. The full InChI is InChI=1S/C33H34/c1-2-6-5(1)9-10(6)12-11(9)13-14(12)16-15(13)17-18(16)20-19(17)21-26-22(20)28-30-25-8-4-3-7-23(8)31(25)24(7)29-27(21)32(26,28)33(29,30)31/h5-30H,1-4H2.
What are the key properties of heptadecacyclo[16.14.1.02,17.03,16.04,15.05,14.06,13.07,12.08,11.019,22.020,32.020,33.021,24.021,31.023,26.024,30.025,29]tritriacontane?
heptadecacyclo[16.14.1.02,17.03,16.04,15.05,14.06,13.07,12.08,11.019,22.020,32.020,33.021,24.021,31.023,26.024,30.025,29]tritriacontane has a molecular weight of 430.64 g/mol, XLogP of 4.76, 0 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for heptadecacyclo[16.14.1.02,17.03,16.04,15.05,14.06,13.07,12.08,11.019,22.020,32.020,33.021,24.021,31.023,26.024,30.025,29]tritriacontane is sourced from PubChem (CID 59762676), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).