2-butan-2-yl-5-cyclopentylcyclopentan-1-ol

C14H26O — CID 22937274

IUPAC2-butan-2-yl-5-cyclopentylcyclopentan-1-ol
SMILESCCC(C)C1CCC(C2CCCC2)C1O
InChIInChI=1S/C14H26O/c1-3-10(2)12-8-9-13(14(12)15)11-6-4-5-7-11/h10-15H,3-9H2,1-2H3
InChIKeyXYYJEXURXYXKMT-UHFFFAOYSA-N
MW210.36 g/mol
LogP3.61
Rot. Bonds3

About 2-butan-2-yl-5-cyclopentylcyclopentan-1-ol

2-butan-2-yl-5-cyclopentylcyclopentan-1-ol (PubChem CID 22937274) has the molecular formula C14H26O and a molecular weight of 210.36 g/mol. Its IUPAC name is 2-butan-2-yl-5-cyclopentylcyclopentan-1-ol.

Molecular Properties

Compound Name2-butan-2-yl-5-cyclopentylcyclopentan-1-ol
PubChem CID22937274
Molecular FormulaC14H26O
Molecular Weight210.36 g/mol
Exact Mass210.20
IUPAC Name2-butan-2-yl-5-cyclopentylcyclopentan-1-ol
SMILESCCC(C)C1CCC(C2CCCC2)C1O
InChIInChI=1S/C14H26O/c1-3-10(2)12-8-9-13(14(12)15)11-6-4-5-7-11/h10-15H,3-9H2,1-2H3
InChIKeyXYYJEXURXYXKMT-UHFFFAOYSA-N
XLogP3.61
TPSA20.23 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds3
Heavy Atoms15
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500210.36
LogP ≤ 53.61
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

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Frequently Asked Questions

What is the IUPAC name of 2-butan-2-yl-5-cyclopentylcyclopentan-1-ol?
The IUPAC name of 2-butan-2-yl-5-cyclopentylcyclopentan-1-ol (CID 22937274) is 2-butan-2-yl-5-cyclopentylcyclopentan-1-ol.
What is the SMILES notation for 2-butan-2-yl-5-cyclopentylcyclopentan-1-ol?
The canonical SMILES for 2-butan-2-yl-5-cyclopentylcyclopentan-1-ol is CCC(C)C1CCC(C2CCCC2)C1O.
What is the InChIKey of 2-butan-2-yl-5-cyclopentylcyclopentan-1-ol?
The InChIKey is XYYJEXURXYXKMT-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H26O/c1-3-10(2)12-8-9-13(14(12)15)11-6-4-5-7-11/h10-15H,3-9H2,1-2H3.
What are the key properties of 2-butan-2-yl-5-cyclopentylcyclopentan-1-ol?
2-butan-2-yl-5-cyclopentylcyclopentan-1-ol has a molecular weight of 210.36 g/mol, XLogP of 3.61, 3 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 2-butan-2-yl-5-cyclopentylcyclopentan-1-ol is sourced from PubChem (CID 22937274), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).