4,8,12,14-tetramethyl-5-propan-2-ylpentacyclo[8.6.0.02,9.03,6.013,16]hexadecane

C23H38 — CID 123539722

IUPAC4,8,12,14-tetramethyl-5-propan-2-ylpentacyclo[8.6.0.02,9.03,6.013,16]hexadecane
SMILESCC(C)C1C(C)C2C1CC(C)C1C3CC(C)C4C(C)CC4C3C12
InChIInChI=1S/C23H38/c1-10(2)18-14(6)21-15(18)9-13(5)20-17-8-12(4)19-11(3)7-16(19)22(17)23(20)21/h10-23H,7-9H2,1-6H3
InChIKeyIMNBUUZQOSVQFC-UHFFFAOYSA-N
MW314.56 g/mol
LogP5.97
Rot. Bonds1

About 4,8,12,14-tetramethyl-5-propan-2-ylpentacyclo[8.6.0.02,9.03,6.013,16]hexadecane

4,8,12,14-tetramethyl-5-propan-2-ylpentacyclo[8.6.0.02,9.03,6.013,16]hexadecane (PubChem CID 123539722) has the molecular formula C23H38 and a molecular weight of 314.56 g/mol. Its IUPAC name is 4,8,12,14-tetramethyl-5-propan-2-ylpentacyclo[8.6.0.02,9.03,6.013,16]hexadecane.

Molecular Properties

Compound Name4,8,12,14-tetramethyl-5-propan-2-ylpentacyclo[8.6.0.02,9.03,6.013,16]hexadecane
PubChem CID123539722
Molecular FormulaC23H38
Molecular Weight314.56 g/mol
Exact Mass314.30
IUPAC Name4,8,12,14-tetramethyl-5-propan-2-ylpentacyclo[8.6.0.02,9.03,6.013,16]hexadecane
SMILESCC(C)C1C(C)C2C1CC(C)C1C3CC(C)C4C(C)CC4C3C12
InChIInChI=1S/C23H38/c1-10(2)18-14(6)21-15(18)9-13(5)20-17-8-12(4)19-11(3)7-16(19)22(17)23(20)21/h10-23H,7-9H2,1-6H3
InChIKeyIMNBUUZQOSVQFC-UHFFFAOYSA-N
XLogP5.97
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds1
Heavy Atoms23
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500314.56
LogP ≤ 55.97
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 100

Analyze 4,8,12,14-tetramethyl-5-propan-2-ylpentacyclo[8.6.0.02,9.03,6.013,16]hexadecane 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

2-methyl-5-propan-2-ylbicyclo[2.1.0]pentane
CID 91265668
3,6-dimethyltricyclo[3.3.0.02,8]octane
CID 123298522
3-ethyl-2,7-dimethyl-6-propan-2-ylbicyclo[3.2.0]heptane
CID 123742163
1-cyclopropyl-2,4-dimethyl-3-propan-2-ylcyclopentane
CID 123954813
3,5,8-trimethyl-7-propan-2-yltricyclo[4.2.0.02,4]octane
CID 123828648
2,4,6-trimethyl-7-[1-(2-propan-2-ylcyclopropyl)ethyl]bicyclo[3.2.0]heptane
CID 123771823
N-(5-methyl-7-propan-2-yl-3-bicyclo[4.1.0]heptanyl)acetamide
CID 146534371
4,5,11,12-tetramethylhexacyclo[6.6.1.13,6.110,13.02,7.09,14]heptadecane
CID 23600006
1,3-dimethyl-2-(2-methylcyclopropyl)cyclobutane
CID 91132090
1,2,3,4-tetramethyl-6-propan-2-ylcycloheptane
CID 90791175
4,11-dimethylpentacyclo[7.4.0.02,7.03,6.010,13]tridecane;ethane;prop-1-ene
CID 145357305
11-methyl-12-propan-2-ylbicyclo[8.2.0]dodecane
CID 91043765

Frequently Asked Questions

What is the IUPAC name of 4,8,12,14-tetramethyl-5-propan-2-ylpentacyclo[8.6.0.02,9.03,6.013,16]hexadecane?
The IUPAC name of 4,8,12,14-tetramethyl-5-propan-2-ylpentacyclo[8.6.0.02,9.03,6.013,16]hexadecane (CID 123539722) is 4,8,12,14-tetramethyl-5-propan-2-ylpentacyclo[8.6.0.02,9.03,6.013,16]hexadecane.
What is the SMILES notation for 4,8,12,14-tetramethyl-5-propan-2-ylpentacyclo[8.6.0.02,9.03,6.013,16]hexadecane?
The canonical SMILES for 4,8,12,14-tetramethyl-5-propan-2-ylpentacyclo[8.6.0.02,9.03,6.013,16]hexadecane is CC(C)C1C(C)C2C1CC(C)C1C3CC(C)C4C(C)CC4C3C12.
What is the InChIKey of 4,8,12,14-tetramethyl-5-propan-2-ylpentacyclo[8.6.0.02,9.03,6.013,16]hexadecane?
The InChIKey is IMNBUUZQOSVQFC-UHFFFAOYSA-N. The full InChI is InChI=1S/C23H38/c1-10(2)18-14(6)21-15(18)9-13(5)20-17-8-12(4)19-11(3)7-16(19)22(17)23(20)21/h10-23H,7-9H2,1-6H3.
What are the key properties of 4,8,12,14-tetramethyl-5-propan-2-ylpentacyclo[8.6.0.02,9.03,6.013,16]hexadecane?
4,8,12,14-tetramethyl-5-propan-2-ylpentacyclo[8.6.0.02,9.03,6.013,16]hexadecane has a molecular weight of 314.56 g/mol, XLogP of 5.97, 1 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for 4,8,12,14-tetramethyl-5-propan-2-ylpentacyclo[8.6.0.02,9.03,6.013,16]hexadecane is sourced from PubChem (CID 123539722), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).