(1R)-5-methyltricyclo[5.3.0.02,6]dec-3-ene

C11H16 — CID 163443583

IUPAC(1R)-5-methyltricyclo[5.3.0.02,6]dec-3-ene
SMILESCC1C=CC2C1C1CCC[C@@H]21
InChIInChI=1S/C11H16/c1-7-5-6-10-8-3-2-4-9(8)11(7)10/h5-11H,2-4H2,1H3/t7?,8-,9?,10?,11?/m1/s1
InChIKeyBAPRAIHDVNCPRS-IYBWKAHUSA-N
MW148.25 g/mol
LogP2.85
Rot. Bonds

About (1R)-5-methyltricyclo[5.3.0.02,6]dec-3-ene

(1R)-5-methyltricyclo[5.3.0.02,6]dec-3-ene (PubChem CID 163443583) has the molecular formula C11H16 and a molecular weight of 148.25 g/mol. Its IUPAC name is (1R)-5-methyltricyclo[5.3.0.02,6]dec-3-ene.

Molecular Properties

Compound Name(1R)-5-methyltricyclo[5.3.0.02,6]dec-3-ene
PubChem CID163443583
Molecular FormulaC11H16
Molecular Weight148.25 g/mol
Exact Mass148.13
IUPAC Name(1R)-5-methyltricyclo[5.3.0.02,6]dec-3-ene
SMILESCC1C=CC2C1C1CCC[C@@H]21
InChIInChI=1S/C11H16/c1-7-5-6-10-8-3-2-4-9(8)11(7)10/h5-11H,2-4H2,1H3/t7?,8-,9?,10?,11?/m1/s1
InChIKeyBAPRAIHDVNCPRS-IYBWKAHUSA-N
XLogP2.85
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500148.25
LogP ≤ 52.85
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

(1S,2S,5R,6R,7R)-5-methoxytricyclo[5.4.0.02,6]undec-3-ene
CID 25146734
(1R,2S,5R,6R,7S)-5-methyltricyclo[5.2.1.02,6]deca-3,8-diene
CID 124560087
(7S,8S)-tetracyclo[5.4.0.02,6.08,11]undecane
CID 163896911
(1S,2R,3aR,4S,6aR)-1,2,4-trimethyl-1,2,3,3a,4,6a-hexahydropentalene
CID 162412469
(3aS,4S,7S,7aR)-2,4-dimethyl-7-[(1R,2R)-2-methylcyclohexyl]-3a,4,7,7a-tetrahydroisoindole-1,3-dione
CID 10564344
7-methyltricyclo[4.3.0.02,9]nonane
CID 152833936
ethane;tricyclo[5.3.0.02,6]decane
CID 158606562
carbanide;bis(cyclopentane);bis(dichlorozirconium(2+));6-methyl-2,3,3a,6,6a,7,8,9,9a,9b-decahydro-1H-cyclopenta[e]azulene
CID 162287906
cis-(1S,2R)-1-methyl-2-[(1R)-2-methylcyclopentyl]cyclopentane
CID 91373089
(2S,5R)-2,5-dimethylbicyclo[4.1.0]hept-3-ene
CID 134980109
pentacyclo[10.8.0.02,11.06,17.07,16]icosane
CID 101138772
4-(2-methylcyclohexyl)-3a,4,5,6,7,7a-hexahydro-1-benzofuran
CID 142057992

Frequently Asked Questions

What is the IUPAC name of (1R)-5-methyltricyclo[5.3.0.02,6]dec-3-ene?
The IUPAC name of (1R)-5-methyltricyclo[5.3.0.02,6]dec-3-ene (CID 163443583) is (1R)-5-methyltricyclo[5.3.0.02,6]dec-3-ene.
What is the SMILES notation for (1R)-5-methyltricyclo[5.3.0.02,6]dec-3-ene?
The canonical SMILES for (1R)-5-methyltricyclo[5.3.0.02,6]dec-3-ene is CC1C=CC2C1C1CCC[C@@H]21.
What is the InChIKey of (1R)-5-methyltricyclo[5.3.0.02,6]dec-3-ene?
The InChIKey is BAPRAIHDVNCPRS-IYBWKAHUSA-N. The full InChI is InChI=1S/C11H16/c1-7-5-6-10-8-3-2-4-9(8)11(7)10/h5-11H,2-4H2,1H3/t7?,8-,9?,10?,11?/m1/s1.
What are the key properties of (1R)-5-methyltricyclo[5.3.0.02,6]dec-3-ene?
(1R)-5-methyltricyclo[5.3.0.02,6]dec-3-ene has a molecular weight of 148.25 g/mol, XLogP of 2.85, 0 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for (1R)-5-methyltricyclo[5.3.0.02,6]dec-3-ene is sourced from PubChem (CID 163443583), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).