1-methyl-2,4,6,8-tetramethylideneadamantane

C15H18 — CID 175332216

IUPAC1-methyl-2,4,6,8-tetramethylideneadamantane
SMILESC=C1C2CC3(C)C(=C)C1CC(C2=C)C3=C
InChIInChI=1S/C15H18/c1-8-12-6-13-9(2)14(8)7-15(5,10(12)3)11(13)4/h12-14H,1-4,6-7H2,5H3
InChIKeyOVTWXFCWFKBPOG-UHFFFAOYSA-N
MW198.31 g/mol
LogP3.89
Rot. Bonds

About 1-methyl-2,4,6,8-tetramethylideneadamantane

1-methyl-2,4,6,8-tetramethylideneadamantane (PubChem CID 175332216) has the molecular formula C15H18 and a molecular weight of 198.31 g/mol. Its IUPAC name is 1-methyl-2,4,6,8-tetramethylideneadamantane.

Molecular Properties

Compound Name1-methyl-2,4,6,8-tetramethylideneadamantane
PubChem CID175332216
Molecular FormulaC15H18
Molecular Weight198.31 g/mol
Exact Mass198.14
IUPAC Name1-methyl-2,4,6,8-tetramethylideneadamantane
SMILESC=C1C2CC3(C)C(=C)C1CC(C2=C)C3=C
InChIInChI=1S/C15H18/c1-8-12-6-13-9(2)14(8)7-15(5,10(12)3)11(13)4/h12-14H,1-4,6-7H2,5H3
InChIKeyOVTWXFCWFKBPOG-UHFFFAOYSA-N
XLogP3.89
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500198.31
LogP ≤ 53.89
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 100

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'isolated_alkene', 'substructure': 'N/A'}

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Frequently Asked Questions

What is the IUPAC name of 1-methyl-2,4,6,8-tetramethylideneadamantane?
The IUPAC name of 1-methyl-2,4,6,8-tetramethylideneadamantane (CID 175332216) is 1-methyl-2,4,6,8-tetramethylideneadamantane.
What is the SMILES notation for 1-methyl-2,4,6,8-tetramethylideneadamantane?
The canonical SMILES for 1-methyl-2,4,6,8-tetramethylideneadamantane is C=C1C2CC3(C)C(=C)C1CC(C2=C)C3=C.
What is the InChIKey of 1-methyl-2,4,6,8-tetramethylideneadamantane?
The InChIKey is OVTWXFCWFKBPOG-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H18/c1-8-12-6-13-9(2)14(8)7-15(5,10(12)3)11(13)4/h12-14H,1-4,6-7H2,5H3.
What are the key properties of 1-methyl-2,4,6,8-tetramethylideneadamantane?
1-methyl-2,4,6,8-tetramethylideneadamantane has a molecular weight of 198.31 g/mol, XLogP of 3.89, 0 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for 1-methyl-2,4,6,8-tetramethylideneadamantane is sourced from PubChem (CID 175332216), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).