1,3,3,10-tetramethyltricyclo[6.3.1.02,7]dodecane

C16H28 — CID 57158600

IUPAC1,3,3,10-tetramethyltricyclo[6.3.1.02,7]dodecane
SMILESCC1CC2CC(C)(C1)C1C2CCCC1(C)C
InChIInChI=1S/C16H28/c1-11-8-12-10-16(4,9-11)14-13(12)6-5-7-15(14,2)3/h11-14H,5-10H2,1-4H3
InChIKeyZUWRZQCRPTVUET-UHFFFAOYSA-N
MW220.40 g/mol
LogP4.89
Rot. Bonds

About 1,3,3,10-tetramethyltricyclo[6.3.1.02,7]dodecane

1,3,3,10-tetramethyltricyclo[6.3.1.02,7]dodecane (PubChem CID 57158600) has the molecular formula C16H28 and a molecular weight of 220.40 g/mol. Its IUPAC name is 1,3,3,10-tetramethyltricyclo[6.3.1.02,7]dodecane.

Molecular Properties

Compound Name1,3,3,10-tetramethyltricyclo[6.3.1.02,7]dodecane
PubChem CID57158600
Molecular FormulaC16H28
Molecular Weight220.40 g/mol
Exact Mass220.22
IUPAC Name1,3,3,10-tetramethyltricyclo[6.3.1.02,7]dodecane
SMILESCC1CC2CC(C)(C1)C1C2CCCC1(C)C
InChIInChI=1S/C16H28/c1-11-8-12-10-16(4,9-11)14-13(12)6-5-7-15(14,2)3/h11-14H,5-10H2,1-4H3
InChIKeyZUWRZQCRPTVUET-UHFFFAOYSA-N
XLogP4.89
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500220.40
LogP ≤ 54.89
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 100

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Frequently Asked Questions

What is the IUPAC name of 1,3,3,10-tetramethyltricyclo[6.3.1.02,7]dodecane?
The IUPAC name of 1,3,3,10-tetramethyltricyclo[6.3.1.02,7]dodecane (CID 57158600) is 1,3,3,10-tetramethyltricyclo[6.3.1.02,7]dodecane.
What is the SMILES notation for 1,3,3,10-tetramethyltricyclo[6.3.1.02,7]dodecane?
The canonical SMILES for 1,3,3,10-tetramethyltricyclo[6.3.1.02,7]dodecane is CC1CC2CC(C)(C1)C1C2CCCC1(C)C.
What is the InChIKey of 1,3,3,10-tetramethyltricyclo[6.3.1.02,7]dodecane?
The InChIKey is ZUWRZQCRPTVUET-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H28/c1-11-8-12-10-16(4,9-11)14-13(12)6-5-7-15(14,2)3/h11-14H,5-10H2,1-4H3.
What are the key properties of 1,3,3,10-tetramethyltricyclo[6.3.1.02,7]dodecane?
1,3,3,10-tetramethyltricyclo[6.3.1.02,7]dodecane has a molecular weight of 220.40 g/mol, XLogP of 4.89, 0 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for 1,3,3,10-tetramethyltricyclo[6.3.1.02,7]dodecane is sourced from PubChem (CID 57158600), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).