1,2,2,3,3,4,4,5,6,6,7,7,8,9,9-pentadecamethylbicyclo[3.3.1]nonane

C24H46 — CID 143197426

IUPAC1,2,2,3,3,4,4,5,6,6,7,7,8,9,9-pentadecamethylbicyclo[3.3.1]nonane
SMILESCC1C(C)(C)C(C)(C)C2(C)C(C)(C)C(C)(C)C(C)(C)C1(C)C2(C)C
InChIInChI=1S/C24H46/c1-16-17(2,3)18(4,5)24(15)21(10,11)19(6,7)20(8,9)23(16,14)22(24,12)13/h16H,1-15H3
InChIKeyUGHKFDVKKIRZIQ-UHFFFAOYSA-N
MW334.63 g/mol
LogP7.82
Rot. Bonds

About 1,2,2,3,3,4,4,5,6,6,7,7,8,9,9-pentadecamethylbicyclo[3.3.1]nonane

1,2,2,3,3,4,4,5,6,6,7,7,8,9,9-pentadecamethylbicyclo[3.3.1]nonane (PubChem CID 143197426) has the molecular formula C24H46 and a molecular weight of 334.63 g/mol. Its IUPAC name is 1,2,2,3,3,4,4,5,6,6,7,7,8,9,9-pentadecamethylbicyclo[3.3.1]nonane.

Molecular Properties

Compound Name1,2,2,3,3,4,4,5,6,6,7,7,8,9,9-pentadecamethylbicyclo[3.3.1]nonane
PubChem CID143197426
Molecular FormulaC24H46
Molecular Weight334.63 g/mol
Exact Mass334.36
IUPAC Name1,2,2,3,3,4,4,5,6,6,7,7,8,9,9-pentadecamethylbicyclo[3.3.1]nonane
SMILESCC1C(C)(C)C(C)(C)C2(C)C(C)(C)C(C)(C)C(C)(C)C1(C)C2(C)C
InChIInChI=1S/C24H46/c1-16-17(2,3)18(4,5)24(15)21(10,11)19(6,7)20(8,9)23(16,14)22(24,12)13/h16H,1-15H3
InChIKeyUGHKFDVKKIRZIQ-UHFFFAOYSA-N
XLogP7.82
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds
Heavy Atoms24
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500334.63
LogP ≤ 57.82
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 100

Analyze 1,2,2,3,3,4,4,5,6,6,7,7,8,9,9-pentadecamethylbicyclo[3.3.1]nonane with MolForge

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Related Compounds

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CID 123795452
1,1,2,2,3,3,4,4,5,5,6,6,7,7-tetradecamethylcycloheptane
CID 23565911
1,2,3,4,4,5,5,6,6,7,8,9,9,10,11,12,13,13,14,14,15,16-docosamethylhexacyclo[8.6.0.02,8.03,7.011,16.012,15]hexadecane
CID 123205214
CID 174023476
CID 174023476
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CID 14202704
1,2,3,4,4,5,5,6,7,8,9,10,10,11,11,12,12,13,14,14,15,15-docosamethylpentacyclo[6.5.1.13,6.02,7.09,13]pentadecane
CID 58944237
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cis-(1R,3R)-1-chloro-1-fluoro-2,2,3-trimethylcyclopropane
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1,2,2,3,4,6-hexamethylbicyclo[2.2.0]hexane
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(1,2,2,3,3,4,4,5-octamethylcyclopentyl)-silyloxysilane
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Frequently Asked Questions

What is the IUPAC name of 1,2,2,3,3,4,4,5,6,6,7,7,8,9,9-pentadecamethylbicyclo[3.3.1]nonane?
The IUPAC name of 1,2,2,3,3,4,4,5,6,6,7,7,8,9,9-pentadecamethylbicyclo[3.3.1]nonane (CID 143197426) is 1,2,2,3,3,4,4,5,6,6,7,7,8,9,9-pentadecamethylbicyclo[3.3.1]nonane.
What is the SMILES notation for 1,2,2,3,3,4,4,5,6,6,7,7,8,9,9-pentadecamethylbicyclo[3.3.1]nonane?
The canonical SMILES for 1,2,2,3,3,4,4,5,6,6,7,7,8,9,9-pentadecamethylbicyclo[3.3.1]nonane is CC1C(C)(C)C(C)(C)C2(C)C(C)(C)C(C)(C)C(C)(C)C1(C)C2(C)C.
What is the InChIKey of 1,2,2,3,3,4,4,5,6,6,7,7,8,9,9-pentadecamethylbicyclo[3.3.1]nonane?
The InChIKey is UGHKFDVKKIRZIQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C24H46/c1-16-17(2,3)18(4,5)24(15)21(10,11)19(6,7)20(8,9)23(16,14)22(24,12)13/h16H,1-15H3.
What are the key properties of 1,2,2,3,3,4,4,5,6,6,7,7,8,9,9-pentadecamethylbicyclo[3.3.1]nonane?
1,2,2,3,3,4,4,5,6,6,7,7,8,9,9-pentadecamethylbicyclo[3.3.1]nonane has a molecular weight of 334.63 g/mol, XLogP of 7.82, 0 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for 1,2,2,3,3,4,4,5,6,6,7,7,8,9,9-pentadecamethylbicyclo[3.3.1]nonane is sourced from PubChem (CID 143197426), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).