7,12,14-trimethyltetracyclo[8.5.0.02,8.04,6]pentadecane

C18H30 — CID 123453838

IUPAC7,12,14-trimethyltetracyclo[8.5.0.02,8.04,6]pentadecane
SMILESCC1CC(C)CC2C(C1)CC1C(C)C3CC3CC21
InChIInChI=1S/C18H30/c1-10-4-11(2)6-17-13(5-10)8-16-12(3)15-7-14(15)9-18(16)17/h10-18H,4-9H2,1-3H3
InChIKeyBGVOJZHIVJNHOP-UHFFFAOYSA-N
MW246.44 g/mol
LogP4.99
Rot. Bonds

About 7,12,14-trimethyltetracyclo[8.5.0.02,8.04,6]pentadecane

7,12,14-trimethyltetracyclo[8.5.0.02,8.04,6]pentadecane (PubChem CID 123453838) has the molecular formula C18H30 and a molecular weight of 246.44 g/mol. Its IUPAC name is 7,12,14-trimethyltetracyclo[8.5.0.02,8.04,6]pentadecane.

Molecular Properties

Compound Name7,12,14-trimethyltetracyclo[8.5.0.02,8.04,6]pentadecane
PubChem CID123453838
Molecular FormulaC18H30
Molecular Weight246.44 g/mol
Exact Mass246.23
IUPAC Name7,12,14-trimethyltetracyclo[8.5.0.02,8.04,6]pentadecane
SMILESCC1CC(C)CC2C(C1)CC1C(C)C3CC3CC21
InChIInChI=1S/C18H30/c1-10-4-11(2)6-17-13(5-10)8-16-12(3)15-7-14(15)9-18(16)17/h10-18H,4-9H2,1-3H3
InChIKeyBGVOJZHIVJNHOP-UHFFFAOYSA-N
XLogP4.99
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500246.44
LogP ≤ 54.99
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 100

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Frequently Asked Questions

What is the IUPAC name of 7,12,14-trimethyltetracyclo[8.5.0.02,8.04,6]pentadecane?
The IUPAC name of 7,12,14-trimethyltetracyclo[8.5.0.02,8.04,6]pentadecane (CID 123453838) is 7,12,14-trimethyltetracyclo[8.5.0.02,8.04,6]pentadecane.
What is the SMILES notation for 7,12,14-trimethyltetracyclo[8.5.0.02,8.04,6]pentadecane?
The canonical SMILES for 7,12,14-trimethyltetracyclo[8.5.0.02,8.04,6]pentadecane is CC1CC(C)CC2C(C1)CC1C(C)C3CC3CC21.
What is the InChIKey of 7,12,14-trimethyltetracyclo[8.5.0.02,8.04,6]pentadecane?
The InChIKey is BGVOJZHIVJNHOP-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H30/c1-10-4-11(2)6-17-13(5-10)8-16-12(3)15-7-14(15)9-18(16)17/h10-18H,4-9H2,1-3H3.
What are the key properties of 7,12,14-trimethyltetracyclo[8.5.0.02,8.04,6]pentadecane?
7,12,14-trimethyltetracyclo[8.5.0.02,8.04,6]pentadecane has a molecular weight of 246.44 g/mol, XLogP of 4.99, 0 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for 7,12,14-trimethyltetracyclo[8.5.0.02,8.04,6]pentadecane is sourced from PubChem (CID 123453838), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).