7-methyl-8-phenyltricyclo[4.2.2.02,5]dec-7-ene

C17H20 — CID 15904382

IUPAC7-methyl-8-phenyltricyclo[4.2.2.02,5]dec-7-ene
SMILESCC1=C(c2ccccc2)C2CCC1C1CCC21
InChIInChI=1S/C17H20/c1-11-13-7-10-16(15-9-8-14(13)15)17(11)12-5-3-2-4-6-12/h2-6,13-16H,7-10H2,1H3
InChIKeyMUCBRPLDZTVXIW-UHFFFAOYSA-N
MW224.35 g/mol
LogP4.53
Rot. Bonds1

About 7-methyl-8-phenyltricyclo[4.2.2.02,5]dec-7-ene

7-methyl-8-phenyltricyclo[4.2.2.02,5]dec-7-ene (PubChem CID 15904382) has the molecular formula C17H20 and a molecular weight of 224.35 g/mol. Its IUPAC name is 7-methyl-8-phenyltricyclo[4.2.2.02,5]dec-7-ene.

Molecular Properties

Compound Name7-methyl-8-phenyltricyclo[4.2.2.02,5]dec-7-ene
PubChem CID15904382
Molecular FormulaC17H20
Molecular Weight224.35 g/mol
Exact Mass224.16
IUPAC Name7-methyl-8-phenyltricyclo[4.2.2.02,5]dec-7-ene
SMILESCC1=C(c2ccccc2)C2CCC1C1CCC21
InChIInChI=1S/C17H20/c1-11-13-7-10-16(15-9-8-14(13)15)17(11)12-5-3-2-4-6-12/h2-6,13-16H,7-10H2,1H3
InChIKeyMUCBRPLDZTVXIW-UHFFFAOYSA-N
XLogP4.53
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds1
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500224.35
LogP ≤ 54.53
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 100

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Frequently Asked Questions

What is the IUPAC name of 7-methyl-8-phenyltricyclo[4.2.2.02,5]dec-7-ene?
The IUPAC name of 7-methyl-8-phenyltricyclo[4.2.2.02,5]dec-7-ene (CID 15904382) is 7-methyl-8-phenyltricyclo[4.2.2.02,5]dec-7-ene.
What is the SMILES notation for 7-methyl-8-phenyltricyclo[4.2.2.02,5]dec-7-ene?
The canonical SMILES for 7-methyl-8-phenyltricyclo[4.2.2.02,5]dec-7-ene is CC1=C(c2ccccc2)C2CCC1C1CCC21.
What is the InChIKey of 7-methyl-8-phenyltricyclo[4.2.2.02,5]dec-7-ene?
The InChIKey is MUCBRPLDZTVXIW-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H20/c1-11-13-7-10-16(15-9-8-14(13)15)17(11)12-5-3-2-4-6-12/h2-6,13-16H,7-10H2,1H3.
What are the key properties of 7-methyl-8-phenyltricyclo[4.2.2.02,5]dec-7-ene?
7-methyl-8-phenyltricyclo[4.2.2.02,5]dec-7-ene has a molecular weight of 224.35 g/mol, XLogP of 4.53, 1 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for 7-methyl-8-phenyltricyclo[4.2.2.02,5]dec-7-ene is sourced from PubChem (CID 15904382), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).