4,5-dimethyltetracyclo[3.3.0.01,3.02,7]octane

C10H14 — CID 123628540

IUPAC4,5-dimethyltetracyclo[3.3.0.01,3.02,7]octane
SMILESCC1C2C3C4CC1(C)C32C4
InChIInChI=1S/C10H14/c1-5-7-8-6-3-9(5,2)10(7,8)4-6/h5-8H,3-4H2,1-2H3
InChIKeyUNWSRYHVLWBPMO-UHFFFAOYSA-N
MW134.22 g/mol
LogP2.30
Rot. Bonds

About 4,5-dimethyltetracyclo[3.3.0.01,3.02,7]octane

4,5-dimethyltetracyclo[3.3.0.01,3.02,7]octane (PubChem CID 123628540) has the molecular formula C10H14 and a molecular weight of 134.22 g/mol. Its IUPAC name is 4,5-dimethyltetracyclo[3.3.0.01,3.02,7]octane.

Molecular Properties

Compound Name4,5-dimethyltetracyclo[3.3.0.01,3.02,7]octane
PubChem CID123628540
Molecular FormulaC10H14
Molecular Weight134.22 g/mol
Exact Mass134.11
IUPAC Name4,5-dimethyltetracyclo[3.3.0.01,3.02,7]octane
SMILESCC1C2C3C4CC1(C)C32C4
InChIInChI=1S/C10H14/c1-5-7-8-6-3-9(5,2)10(7,8)4-6/h5-8H,3-4H2,1-2H3
InChIKeyUNWSRYHVLWBPMO-UHFFFAOYSA-N
XLogP2.30
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds
Heavy Atoms10
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500134.22
LogP ≤ 52.30
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 100

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Related Compounds

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(1,2-dimethylcyclopropyl) carbonochloridate
CID 57006393
5,7,8-trimethyltricyclo[5.2.1.02,6]decan-8-ol
CID 89145281
1-(1,2-dimethylcyclopropyl)oxy-1,2-dimethylcyclopropane
CID 175071290
4,5,6,8-tetramethyltetracyclo[3.3.0.01,3.02,6]octane
CID 123295375
(1,2,3-trimethyl-2-bicyclo[2.2.1]heptanyl) 2-methylprop-2-enoate
CID 174204067
bis(1-methylcyclohexyl) oxalate
CID 154101354
4-(2-methoxy-2-oxoethyl)-2,4-dimethyltricyclo[3.1.1.03,6]heptane-1-carboxylic acid
CID 71193708
(1,2,3,8-tetramethyl-5,5-dioxo-4-oxa-5λ6-thiatricyclo[4.2.1.03,7]nonan-2-yl) 2,2-difluoro-2-oxidoperoxysulfanylacetate
CID 59623186
(1,2,3,8-tetramethyl-5,5-dioxo-4-oxa-5λ6-thiatricyclo[4.2.1.03,7]nonan-2-yl) 2,2-difluoro-2-(trioxidanylsulfanyl)acetate
CID 59623187

Frequently Asked Questions

What is the IUPAC name of 4,5-dimethyltetracyclo[3.3.0.01,3.02,7]octane?
The IUPAC name of 4,5-dimethyltetracyclo[3.3.0.01,3.02,7]octane (CID 123628540) is 4,5-dimethyltetracyclo[3.3.0.01,3.02,7]octane.
What is the SMILES notation for 4,5-dimethyltetracyclo[3.3.0.01,3.02,7]octane?
The canonical SMILES for 4,5-dimethyltetracyclo[3.3.0.01,3.02,7]octane is CC1C2C3C4CC1(C)C32C4.
What is the InChIKey of 4,5-dimethyltetracyclo[3.3.0.01,3.02,7]octane?
The InChIKey is UNWSRYHVLWBPMO-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H14/c1-5-7-8-6-3-9(5,2)10(7,8)4-6/h5-8H,3-4H2,1-2H3.
What are the key properties of 4,5-dimethyltetracyclo[3.3.0.01,3.02,7]octane?
4,5-dimethyltetracyclo[3.3.0.01,3.02,7]octane has a molecular weight of 134.22 g/mol, XLogP of 2.30, 0 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for 4,5-dimethyltetracyclo[3.3.0.01,3.02,7]octane is sourced from PubChem (CID 123628540), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).