hexacyclo[8.3.1.02,9.03,8.04,7.012,14]tetradecane

C14H18 — CID 20665316

IUPAChexacyclo[8.3.1.02,9.03,8.04,7.012,14]tetradecane
SMILESC1CC2C1C1C2C2C3CC4CC(C43)C12
InChIInChI=1S/C14H18/c1-2-7-6(1)11-12(7)14-9-4-5-3-8(10(5)9)13(11)14/h5-14H,1-4H2
InChIKeyDKSRIXBDOTVFGN-UHFFFAOYSA-N
MW186.30 g/mol
LogP2.79
Rot. Bonds

About hexacyclo[8.3.1.02,9.03,8.04,7.012,14]tetradecane

hexacyclo[8.3.1.02,9.03,8.04,7.012,14]tetradecane (PubChem CID 20665316) has the molecular formula C14H18 and a molecular weight of 186.30 g/mol. Its IUPAC name is hexacyclo[8.3.1.02,9.03,8.04,7.012,14]tetradecane.

Molecular Properties

Compound Namehexacyclo[8.3.1.02,9.03,8.04,7.012,14]tetradecane
PubChem CID20665316
Molecular FormulaC14H18
Molecular Weight186.30 g/mol
Exact Mass186.14
IUPAC Namehexacyclo[8.3.1.02,9.03,8.04,7.012,14]tetradecane
SMILESC1CC2C1C1C2C2C3CC4CC(C43)C12
InChIInChI=1S/C14H18/c1-2-7-6(1)11-12(7)14-9-4-5-3-8(10(5)9)13(11)14/h5-14H,1-4H2
InChIKeyDKSRIXBDOTVFGN-UHFFFAOYSA-N
XLogP2.79
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500186.30
LogP ≤ 52.79
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 100

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Frequently Asked Questions

What is the IUPAC name of hexacyclo[8.3.1.02,9.03,8.04,7.012,14]tetradecane?
The IUPAC name of hexacyclo[8.3.1.02,9.03,8.04,7.012,14]tetradecane (CID 20665316) is hexacyclo[8.3.1.02,9.03,8.04,7.012,14]tetradecane.
What is the SMILES notation for hexacyclo[8.3.1.02,9.03,8.04,7.012,14]tetradecane?
The canonical SMILES for hexacyclo[8.3.1.02,9.03,8.04,7.012,14]tetradecane is C1CC2C1C1C2C2C3CC4CC(C43)C12.
What is the InChIKey of hexacyclo[8.3.1.02,9.03,8.04,7.012,14]tetradecane?
The InChIKey is DKSRIXBDOTVFGN-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H18/c1-2-7-6(1)11-12(7)14-9-4-5-3-8(10(5)9)13(11)14/h5-14H,1-4H2.
What are the key properties of hexacyclo[8.3.1.02,9.03,8.04,7.012,14]tetradecane?
hexacyclo[8.3.1.02,9.03,8.04,7.012,14]tetradecane has a molecular weight of 186.30 g/mol, XLogP of 2.79, 0 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for hexacyclo[8.3.1.02,9.03,8.04,7.012,14]tetradecane is sourced from PubChem (CID 20665316), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).