(1R)-1,7,7-trimethyl-2-methylidenebicyclo[2.2.1]heptane

C11H18 — CID 162213995

IUPAC(1R)-1,7,7-trimethyl-2-methylidenebicyclo[2.2.1]heptane
SMILESC=C1CC2CC[C@@]1(C)C2(C)C
InChIInChI=1S/C11H18/c1-8-7-9-5-6-11(8,4)10(9,2)3/h9H,1,5-7H2,2-4H3/t9?,11-/m1/s1
InChIKeyZASFWGOMAIPHLN-HCCKASOXSA-N
MW150.26 g/mol
LogP3.39
Rot. Bonds

About (1R)-1,7,7-trimethyl-2-methylidenebicyclo[2.2.1]heptane

(1R)-1,7,7-trimethyl-2-methylidenebicyclo[2.2.1]heptane (PubChem CID 162213995) has the molecular formula C11H18 and a molecular weight of 150.26 g/mol. Its IUPAC name is (1R)-1,7,7-trimethyl-2-methylidenebicyclo[2.2.1]heptane.

Molecular Properties

Compound Name(1R)-1,7,7-trimethyl-2-methylidenebicyclo[2.2.1]heptane
PubChem CID162213995
Molecular FormulaC11H18
Molecular Weight150.26 g/mol
Exact Mass150.14
IUPAC Name(1R)-1,7,7-trimethyl-2-methylidenebicyclo[2.2.1]heptane
SMILESC=C1CC2CC[C@@]1(C)C2(C)C
InChIInChI=1S/C11H18/c1-8-7-9-5-6-11(8,4)10(9,2)3/h9H,1,5-7H2,2-4H3/t9?,11-/m1/s1
InChIKeyZASFWGOMAIPHLN-HCCKASOXSA-N
XLogP3.39
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500150.26
LogP ≤ 53.39
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 (1R)-1,7,7-trimethyl-2-methylidenebicyclo[2.2.1]heptane?
The IUPAC name of (1R)-1,7,7-trimethyl-2-methylidenebicyclo[2.2.1]heptane (CID 162213995) is (1R)-1,7,7-trimethyl-2-methylidenebicyclo[2.2.1]heptane.
What is the SMILES notation for (1R)-1,7,7-trimethyl-2-methylidenebicyclo[2.2.1]heptane?
The canonical SMILES for (1R)-1,7,7-trimethyl-2-methylidenebicyclo[2.2.1]heptane is C=C1CC2CC[C@@]1(C)C2(C)C.
What is the InChIKey of (1R)-1,7,7-trimethyl-2-methylidenebicyclo[2.2.1]heptane?
The InChIKey is ZASFWGOMAIPHLN-HCCKASOXSA-N. The full InChI is InChI=1S/C11H18/c1-8-7-9-5-6-11(8,4)10(9,2)3/h9H,1,5-7H2,2-4H3/t9?,11-/m1/s1.
What are the key properties of (1R)-1,7,7-trimethyl-2-methylidenebicyclo[2.2.1]heptane?
(1R)-1,7,7-trimethyl-2-methylidenebicyclo[2.2.1]heptane has a molecular weight of 150.26 g/mol, XLogP of 3.39, 0 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for (1R)-1,7,7-trimethyl-2-methylidenebicyclo[2.2.1]heptane is sourced from PubChem (CID 162213995), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).