2-(3,4-dimethylpentan-2-yl)-1,3,4-trimethylcyclopentane

C15H30 — CID 123864307

IUPAC2-(3,4-dimethylpentan-2-yl)-1,3,4-trimethylcyclopentane
SMILESCC(C)C(C)C(C)C1C(C)CC(C)C1C
InChIInChI=1S/C15H30/c1-9(2)12(5)14(7)15-11(4)8-10(3)13(15)6/h9-15H,8H2,1-7H3
InChIKeyFUDOZLNOOFHBHK-UHFFFAOYSA-N
MW210.40 g/mol
LogP4.84
Rot. Bonds3

About 2-(3,4-dimethylpentan-2-yl)-1,3,4-trimethylcyclopentane

2-(3,4-dimethylpentan-2-yl)-1,3,4-trimethylcyclopentane (PubChem CID 123864307) has the molecular formula C15H30 and a molecular weight of 210.40 g/mol. Its IUPAC name is 2-(3,4-dimethylpentan-2-yl)-1,3,4-trimethylcyclopentane.

Molecular Properties

Compound Name2-(3,4-dimethylpentan-2-yl)-1,3,4-trimethylcyclopentane
PubChem CID123864307
Molecular FormulaC15H30
Molecular Weight210.40 g/mol
Exact Mass210.23
IUPAC Name2-(3,4-dimethylpentan-2-yl)-1,3,4-trimethylcyclopentane
SMILESCC(C)C(C)C(C)C1C(C)CC(C)C1C
InChIInChI=1S/C15H30/c1-9(2)12(5)14(7)15-11(4)8-10(3)13(15)6/h9-15H,8H2,1-7H3
InChIKeyFUDOZLNOOFHBHK-UHFFFAOYSA-N
XLogP4.84
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds3
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500210.40
LogP ≤ 54.84
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 100

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Frequently Asked Questions

What is the IUPAC name of 2-(3,4-dimethylpentan-2-yl)-1,3,4-trimethylcyclopentane?
The IUPAC name of 2-(3,4-dimethylpentan-2-yl)-1,3,4-trimethylcyclopentane (CID 123864307) is 2-(3,4-dimethylpentan-2-yl)-1,3,4-trimethylcyclopentane.
What is the SMILES notation for 2-(3,4-dimethylpentan-2-yl)-1,3,4-trimethylcyclopentane?
The canonical SMILES for 2-(3,4-dimethylpentan-2-yl)-1,3,4-trimethylcyclopentane is CC(C)C(C)C(C)C1C(C)CC(C)C1C.
What is the InChIKey of 2-(3,4-dimethylpentan-2-yl)-1,3,4-trimethylcyclopentane?
The InChIKey is FUDOZLNOOFHBHK-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H30/c1-9(2)12(5)14(7)15-11(4)8-10(3)13(15)6/h9-15H,8H2,1-7H3.
What are the key properties of 2-(3,4-dimethylpentan-2-yl)-1,3,4-trimethylcyclopentane?
2-(3,4-dimethylpentan-2-yl)-1,3,4-trimethylcyclopentane has a molecular weight of 210.40 g/mol, XLogP of 4.84, 3 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(3,4-dimethylpentan-2-yl)-1,3,4-trimethylcyclopentane is sourced from PubChem (CID 123864307), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).