10-ethyl-1,11,15,18-tetramethyltetracyclo[10.6.1.03,10.014,16]nonadecane

C25H44 — CID 123563200

IUPAC10-ethyl-1,11,15,18-tetramethyltetracyclo[10.6.1.03,10.014,16]nonadecane
SMILESCCC12CCCCCCC1CC1(C)CC(CC3C(C)C3CC1C)C2C
InChIInChI=1S/C25H44/c1-6-25-12-10-8-7-9-11-21(25)16-24(5)15-20(19(25)4)14-23-18(3)22(23)13-17(24)2/h17-23H,6-16H2,1-5H3
InChIKeyVYFVELUSFNEYOB-UHFFFAOYSA-N
MW344.63 g/mol
LogP7.72
Rot. Bonds1

About 10-ethyl-1,11,15,18-tetramethyltetracyclo[10.6.1.03,10.014,16]nonadecane

10-ethyl-1,11,15,18-tetramethyltetracyclo[10.6.1.03,10.014,16]nonadecane (PubChem CID 123563200) has the molecular formula C25H44 and a molecular weight of 344.63 g/mol. Its IUPAC name is 10-ethyl-1,11,15,18-tetramethyltetracyclo[10.6.1.03,10.014,16]nonadecane.

Molecular Properties

Compound Name10-ethyl-1,11,15,18-tetramethyltetracyclo[10.6.1.03,10.014,16]nonadecane
PubChem CID123563200
Molecular FormulaC25H44
Molecular Weight344.63 g/mol
Exact Mass344.34
IUPAC Name10-ethyl-1,11,15,18-tetramethyltetracyclo[10.6.1.03,10.014,16]nonadecane
SMILESCCC12CCCCCCC1CC1(C)CC(CC3C(C)C3CC1C)C2C
InChIInChI=1S/C25H44/c1-6-25-12-10-8-7-9-11-21(25)16-24(5)15-20(19(25)4)14-23-18(3)22(23)13-17(24)2/h17-23H,6-16H2,1-5H3
InChIKeyVYFVELUSFNEYOB-UHFFFAOYSA-N
XLogP7.72
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds1
Heavy Atoms25
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500344.63
LogP ≤ 57.72
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 100

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Frequently Asked Questions

What is the IUPAC name of 10-ethyl-1,11,15,18-tetramethyltetracyclo[10.6.1.03,10.014,16]nonadecane?
The IUPAC name of 10-ethyl-1,11,15,18-tetramethyltetracyclo[10.6.1.03,10.014,16]nonadecane (CID 123563200) is 10-ethyl-1,11,15,18-tetramethyltetracyclo[10.6.1.03,10.014,16]nonadecane.
What is the SMILES notation for 10-ethyl-1,11,15,18-tetramethyltetracyclo[10.6.1.03,10.014,16]nonadecane?
The canonical SMILES for 10-ethyl-1,11,15,18-tetramethyltetracyclo[10.6.1.03,10.014,16]nonadecane is CCC12CCCCCCC1CC1(C)CC(CC3C(C)C3CC1C)C2C.
What is the InChIKey of 10-ethyl-1,11,15,18-tetramethyltetracyclo[10.6.1.03,10.014,16]nonadecane?
The InChIKey is VYFVELUSFNEYOB-UHFFFAOYSA-N. The full InChI is InChI=1S/C25H44/c1-6-25-12-10-8-7-9-11-21(25)16-24(5)15-20(19(25)4)14-23-18(3)22(23)13-17(24)2/h17-23H,6-16H2,1-5H3.
What are the key properties of 10-ethyl-1,11,15,18-tetramethyltetracyclo[10.6.1.03,10.014,16]nonadecane?
10-ethyl-1,11,15,18-tetramethyltetracyclo[10.6.1.03,10.014,16]nonadecane has a molecular weight of 344.63 g/mol, XLogP of 7.72, 1 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for 10-ethyl-1,11,15,18-tetramethyltetracyclo[10.6.1.03,10.014,16]nonadecane is sourced from PubChem (CID 123563200), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).