2-(2,4-dimethylphenyl)bicyclo[2.2.1]heptane

C15H20 — CID 15514590

IUPAC2-(2,4-dimethylphenyl)bicyclo[2.2.1]heptane
SMILESCc1ccc(C2CC3CCC2C3)c(C)c1
InChIInChI=1S/C15H20/c1-10-3-6-14(11(2)7-10)15-9-12-4-5-13(15)8-12/h3,6-7,12-13,15H,4-5,8-9H2,1-2H3
InChIKeyHGEISANYRHEJRJ-UHFFFAOYSA-N
MW200.33 g/mol
LogP4.21
Rot. Bonds1

About 2-(2,4-dimethylphenyl)bicyclo[2.2.1]heptane

2-(2,4-dimethylphenyl)bicyclo[2.2.1]heptane (PubChem CID 15514590) has the molecular formula C15H20 and a molecular weight of 200.33 g/mol. Its IUPAC name is 2-(2,4-dimethylphenyl)bicyclo[2.2.1]heptane.

Molecular Properties

Compound Name2-(2,4-dimethylphenyl)bicyclo[2.2.1]heptane
PubChem CID15514590
Molecular FormulaC15H20
Molecular Weight200.33 g/mol
Exact Mass200.16
IUPAC Name2-(2,4-dimethylphenyl)bicyclo[2.2.1]heptane
SMILESCc1ccc(C2CC3CCC2C3)c(C)c1
InChIInChI=1S/C15H20/c1-10-3-6-14(11(2)7-10)15-9-12-4-5-13(15)8-12/h3,6-7,12-13,15H,4-5,8-9H2,1-2H3
InChIKeyHGEISANYRHEJRJ-UHFFFAOYSA-N
XLogP4.21
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds1
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500200.33
LogP ≤ 54.21
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 100

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Related Compounds

(1R,2R,4S)-2-(2-methylphenyl)bicyclo[2.2.1]heptane
CID 10397553
2-(2-tert-butyl-5-methylphenyl)bicyclo[2.2.1]heptane
CID 169322267
2,4-dimethyl-1-(2-methylcyclopropyl)benzene
CID 154093761
trans-(1R,2S)-2-(2,4-dimethylphenyl)cyclopropan-1-amine
CID 93299529
1-(2-bromocyclopropyl)-2,4-dimethylbenzene
CID 130539902
2-(2-tert-butyl-3-methylphenyl)bicyclo[2.2.1]heptane
CID 169322208
(1R,2R,4S)-2-(3,5-dimethylphenyl)bicyclo[2.2.1]heptane
CID 101176008
1-(2-bicyclo[2.2.1]heptanyl)-3-methylnaphthalene
CID 153281935
1-(2,4-dimethylcyclohexyl)-2,4-dimethylbenzene
CID 23529825
2-[2-bromo-2-(2,5-dimethylphenyl)ethyl]bicyclo[2.2.1]heptane
CID 55198191
N-(cyclopropylmethyl)-2-(2,4-dimethylphenyl)cyclopropan-1-amine
CID 135160107
2-(2,4-dimethylphenyl)cyclopropane-1-carbonitrile
CID 116836914

Frequently Asked Questions

What is the IUPAC name of 2-(2,4-dimethylphenyl)bicyclo[2.2.1]heptane?
The IUPAC name of 2-(2,4-dimethylphenyl)bicyclo[2.2.1]heptane (CID 15514590) is 2-(2,4-dimethylphenyl)bicyclo[2.2.1]heptane.
What is the SMILES notation for 2-(2,4-dimethylphenyl)bicyclo[2.2.1]heptane?
The canonical SMILES for 2-(2,4-dimethylphenyl)bicyclo[2.2.1]heptane is Cc1ccc(C2CC3CCC2C3)c(C)c1.
What is the InChIKey of 2-(2,4-dimethylphenyl)bicyclo[2.2.1]heptane?
The InChIKey is HGEISANYRHEJRJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H20/c1-10-3-6-14(11(2)7-10)15-9-12-4-5-13(15)8-12/h3,6-7,12-13,15H,4-5,8-9H2,1-2H3.
What are the key properties of 2-(2,4-dimethylphenyl)bicyclo[2.2.1]heptane?
2-(2,4-dimethylphenyl)bicyclo[2.2.1]heptane has a molecular weight of 200.33 g/mol, XLogP of 4.21, 1 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(2,4-dimethylphenyl)bicyclo[2.2.1]heptane is sourced from PubChem (CID 15514590), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).