2,5-dimethyl-3-[(1,3,4-trimethyl-2-bicyclo[1.1.0]butanyl)methyl]bicyclo[2.1.0]pentane

C15H24 — CID 90798329

IUPAC2,5-dimethyl-3-[(1,3,4-trimethyl-2-bicyclo[1.1.0]butanyl)methyl]bicyclo[2.1.0]pentane
SMILESCC1C(CC2C3(C)C(C)C23C)C2C(C)C12
InChIInChI=1S/C15H24/c1-7-10(13-8(2)12(7)13)6-11-14(4)9(3)15(11,14)5/h7-13H,6H2,1-5H3
InChIKeyVDTIMDRMMGKQGE-UHFFFAOYSA-N
MW204.36 g/mol
LogP3.82
Rot. Bonds2

About 2,5-dimethyl-3-[(1,3,4-trimethyl-2-bicyclo[1.1.0]butanyl)methyl]bicyclo[2.1.0]pentane

2,5-dimethyl-3-[(1,3,4-trimethyl-2-bicyclo[1.1.0]butanyl)methyl]bicyclo[2.1.0]pentane (PubChem CID 90798329) has the molecular formula C15H24 and a molecular weight of 204.36 g/mol. Its IUPAC name is 2,5-dimethyl-3-[(1,3,4-trimethyl-2-bicyclo[1.1.0]butanyl)methyl]bicyclo[2.1.0]pentane.

Molecular Properties

Compound Name2,5-dimethyl-3-[(1,3,4-trimethyl-2-bicyclo[1.1.0]butanyl)methyl]bicyclo[2.1.0]pentane
PubChem CID90798329
Molecular FormulaC15H24
Molecular Weight204.36 g/mol
Exact Mass204.19
IUPAC Name2,5-dimethyl-3-[(1,3,4-trimethyl-2-bicyclo[1.1.0]butanyl)methyl]bicyclo[2.1.0]pentane
SMILESCC1C(CC2C3(C)C(C)C23C)C2C(C)C12
InChIInChI=1S/C15H24/c1-7-10(13-8(2)12(7)13)6-11-14(4)9(3)15(11,14)5/h7-13H,6H2,1-5H3
InChIKeyVDTIMDRMMGKQGE-UHFFFAOYSA-N
XLogP3.82
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds2
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500204.36
LogP ≤ 53.82
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 100

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Frequently Asked Questions

What is the IUPAC name of 2,5-dimethyl-3-[(1,3,4-trimethyl-2-bicyclo[1.1.0]butanyl)methyl]bicyclo[2.1.0]pentane?
The IUPAC name of 2,5-dimethyl-3-[(1,3,4-trimethyl-2-bicyclo[1.1.0]butanyl)methyl]bicyclo[2.1.0]pentane (CID 90798329) is 2,5-dimethyl-3-[(1,3,4-trimethyl-2-bicyclo[1.1.0]butanyl)methyl]bicyclo[2.1.0]pentane.
What is the SMILES notation for 2,5-dimethyl-3-[(1,3,4-trimethyl-2-bicyclo[1.1.0]butanyl)methyl]bicyclo[2.1.0]pentane?
The canonical SMILES for 2,5-dimethyl-3-[(1,3,4-trimethyl-2-bicyclo[1.1.0]butanyl)methyl]bicyclo[2.1.0]pentane is CC1C(CC2C3(C)C(C)C23C)C2C(C)C12.
What is the InChIKey of 2,5-dimethyl-3-[(1,3,4-trimethyl-2-bicyclo[1.1.0]butanyl)methyl]bicyclo[2.1.0]pentane?
The InChIKey is VDTIMDRMMGKQGE-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H24/c1-7-10(13-8(2)12(7)13)6-11-14(4)9(3)15(11,14)5/h7-13H,6H2,1-5H3.
What are the key properties of 2,5-dimethyl-3-[(1,3,4-trimethyl-2-bicyclo[1.1.0]butanyl)methyl]bicyclo[2.1.0]pentane?
2,5-dimethyl-3-[(1,3,4-trimethyl-2-bicyclo[1.1.0]butanyl)methyl]bicyclo[2.1.0]pentane has a molecular weight of 204.36 g/mol, XLogP of 3.82, 2 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for 2,5-dimethyl-3-[(1,3,4-trimethyl-2-bicyclo[1.1.0]butanyl)methyl]bicyclo[2.1.0]pentane is sourced from PubChem (CID 90798329), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).