(2R)-4-methyltricyclo[5.2.1.02,6]deca-1(9),5-diene

C11H14 — CID 163995115

IUPAC(2R)-4-methyltricyclo[5.2.1.02,6]deca-1(9),5-diene
SMILESCC1C=C2C3CC=C(C3)[C@H]2C1
InChIInChI=1S/C11H14/c1-7-4-10-8-2-3-9(6-8)11(10)5-7/h2,5,7,9-10H,3-4,6H2,1H3/t7?,9?,10-/m1/s1
InChIKeyUEAFTSGUMDLKMN-YXGXMSFMSA-N
MW146.23 g/mol
LogP2.92
Rot. Bonds

About (2R)-4-methyltricyclo[5.2.1.02,6]deca-1(9),5-diene

(2R)-4-methyltricyclo[5.2.1.02,6]deca-1(9),5-diene (PubChem CID 163995115) has the molecular formula C11H14 and a molecular weight of 146.23 g/mol. Its IUPAC name is (2R)-4-methyltricyclo[5.2.1.02,6]deca-1(9),5-diene.

Molecular Properties

Compound Name(2R)-4-methyltricyclo[5.2.1.02,6]deca-1(9),5-diene
PubChem CID163995115
Molecular FormulaC11H14
Molecular Weight146.23 g/mol
Exact Mass146.11
IUPAC Name(2R)-4-methyltricyclo[5.2.1.02,6]deca-1(9),5-diene
SMILESCC1C=C2C3CC=C(C3)[C@H]2C1
InChIInChI=1S/C11H14/c1-7-4-10-8-2-3-9(6-8)11(10)5-7/h2,5,7,9-10H,3-4,6H2,1H3/t7?,9?,10-/m1/s1
InChIKeyUEAFTSGUMDLKMN-YXGXMSFMSA-N
XLogP2.92
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500146.23
LogP ≤ 52.92
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 100

Computed Properties (RDKit)

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

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Related Compounds

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CID 10441753
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2-methyl-2,3,3a,4,5,6-hexahydro-1H-indene
CID 145030144
(3S)-1,3-dimethylcyclobutene
CID 58737300
2-(3,5-dimethylcyclopenten-1-yl)-3-methylbicyclo[2.2.0]hexane
CID 158280740
[(3R,5R)-3,5-dimethylcyclohexen-1-yl]oxy-trimethylsilane
CID 14226865
(2R,5R,9R,13S,15S)-6-[(E,4S,5R)-4,5-dihydroxyhex-2-en-2-yl]-15-hydroxy-5-methyltetracyclo[11.4.1.02,10.05,9]octadeca-1(17),10-dien-12-one
CID 25017452
(2R,10S,12S)-12-chlorotricyclo[8.4.1.02,7]pentadeca-1(14),7-dien-9-one
CID 162411346
bicyclo[3.2.0]hept-1(7)-ene
CID 86002949
3,7-dimethylbicyclo[3.3.1]non-1-ene
CID 123750976
tricyclo[3.2.1.03,8]oct-1(7)-ene
CID 123400934
(1R,5R)-5-methyl-2-propan-2-ylcyclohex-2-en-1-ol
CID 11116276

Frequently Asked Questions

What is the IUPAC name of (2R)-4-methyltricyclo[5.2.1.02,6]deca-1(9),5-diene?
The IUPAC name of (2R)-4-methyltricyclo[5.2.1.02,6]deca-1(9),5-diene (CID 163995115) is (2R)-4-methyltricyclo[5.2.1.02,6]deca-1(9),5-diene.
What is the SMILES notation for (2R)-4-methyltricyclo[5.2.1.02,6]deca-1(9),5-diene?
The canonical SMILES for (2R)-4-methyltricyclo[5.2.1.02,6]deca-1(9),5-diene is CC1C=C2C3CC=C(C3)[C@H]2C1.
What is the InChIKey of (2R)-4-methyltricyclo[5.2.1.02,6]deca-1(9),5-diene?
The InChIKey is UEAFTSGUMDLKMN-YXGXMSFMSA-N. The full InChI is InChI=1S/C11H14/c1-7-4-10-8-2-3-9(6-8)11(10)5-7/h2,5,7,9-10H,3-4,6H2,1H3/t7?,9?,10-/m1/s1.
What are the key properties of (2R)-4-methyltricyclo[5.2.1.02,6]deca-1(9),5-diene?
(2R)-4-methyltricyclo[5.2.1.02,6]deca-1(9),5-diene has a molecular weight of 146.23 g/mol, XLogP of 2.92, 0 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for (2R)-4-methyltricyclo[5.2.1.02,6]deca-1(9),5-diene is sourced from PubChem (CID 163995115), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).