2,5-dimethyltetracyclo[4.3.0.01,8.02,9]nonane

C11H16 — CID 123838216

IUPAC2,5-dimethyltetracyclo[4.3.0.01,8.02,9]nonane
SMILESCC1CCC2(C)C3C4CC1C432
InChIInChI=1S/C11H16/c1-6-3-4-10(2)9-8-5-7(6)11(8,9)10/h6-9H,3-5H2,1-2H3
InChIKeyJPFLUCUQWGEOOM-UHFFFAOYSA-N
MW148.25 g/mol
LogP2.69
Rot. Bonds

About 2,5-dimethyltetracyclo[4.3.0.01,8.02,9]nonane

2,5-dimethyltetracyclo[4.3.0.01,8.02,9]nonane (PubChem CID 123838216) has the molecular formula C11H16 and a molecular weight of 148.25 g/mol. Its IUPAC name is 2,5-dimethyltetracyclo[4.3.0.01,8.02,9]nonane.

Molecular Properties

Compound Name2,5-dimethyltetracyclo[4.3.0.01,8.02,9]nonane
PubChem CID123838216
Molecular FormulaC11H16
Molecular Weight148.25 g/mol
Exact Mass148.13
IUPAC Name2,5-dimethyltetracyclo[4.3.0.01,8.02,9]nonane
SMILESCC1CCC2(C)C3C4CC1C432
InChIInChI=1S/C11H16/c1-6-3-4-10(2)9-8-5-7(6)11(8,9)10/h6-9H,3-5H2,1-2H3
InChIKeyJPFLUCUQWGEOOM-UHFFFAOYSA-N
XLogP2.69
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 ≤ 52.69
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 100

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Related Compounds

2,3,6,8-tetramethyltricyclo[5.3.1.03,8]undecane
CID 155607777
(1R,2R,3S,6S,7S,8S)-2-(hydroxymethyl)-2,6,8-trimethyltricyclo[5.3.1.03,8]undecan-3-ol
CID 122211308
(1R,2R,4S)-1,2,7,7-tetramethylbicyclo[2.2.1]heptane
CID 123374537
1-methyltricyclo[2.1.0.02,5]pentane
CID 86129037
(1R,3R,6R,8R)-3-hydroxy-6,8-dimethyltricyclo[5.3.1.03,8]undecan-2-one
CID 134857045
1',7'-dimethylspiro[cyclopropane-1,3'-tricyclo[4.1.0.02,4]heptane]
CID 163551381
(1S,2S,4R,5R)-4,5-dimethyl-2-[(1R,2R,4R)-1,7,7-trimethyl-2-bicyclo[2.2.1]heptanyl]cyclohexan-1-ol
CID 98137939
(1R,2R,4R,5S)-4,5-dimethyl-2-[(1R,2R,4S)-1,7,7-trimethyl-2-bicyclo[2.2.1]heptanyl]cyclohexan-1-ol
CID 99979364
(1S,2S,5S)-2,6,6-trimethylbicyclo[3.1.1]heptane
CID 6429433
azane;(5R)-2,6,6-trimethylbicyclo[3.1.1]heptane
CID 143055597
2,6,6-trimethyl-2-(2,6,6-trimethyl-2-bicyclo[3.1.1]heptanyl)bicyclo[3.1.1]heptane
CID 23528933
4-methyl-3-[(1S,2S,4R)-1,7,7-trimethyl-2-bicyclo[2.2.1]heptanyl]cyclohexan-1-ol
CID 101328518

Frequently Asked Questions

What is the IUPAC name of 2,5-dimethyltetracyclo[4.3.0.01,8.02,9]nonane?
The IUPAC name of 2,5-dimethyltetracyclo[4.3.0.01,8.02,9]nonane (CID 123838216) is 2,5-dimethyltetracyclo[4.3.0.01,8.02,9]nonane.
What is the SMILES notation for 2,5-dimethyltetracyclo[4.3.0.01,8.02,9]nonane?
The canonical SMILES for 2,5-dimethyltetracyclo[4.3.0.01,8.02,9]nonane is CC1CCC2(C)C3C4CC1C432.
What is the InChIKey of 2,5-dimethyltetracyclo[4.3.0.01,8.02,9]nonane?
The InChIKey is JPFLUCUQWGEOOM-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H16/c1-6-3-4-10(2)9-8-5-7(6)11(8,9)10/h6-9H,3-5H2,1-2H3.
What are the key properties of 2,5-dimethyltetracyclo[4.3.0.01,8.02,9]nonane?
2,5-dimethyltetracyclo[4.3.0.01,8.02,9]nonane has a molecular weight of 148.25 g/mol, XLogP of 2.69, 0 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for 2,5-dimethyltetracyclo[4.3.0.01,8.02,9]nonane is sourced from PubChem (CID 123838216), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).