(1,3-dimethoxy-2-methylpropan-2-yl)cyclopentane

C11H22O2 — CID 89106500

IUPAC(1,3-dimethoxy-2-methylpropan-2-yl)cyclopentane
SMILESCOCC(C)(COC)C1CCCC1
InChIInChI=1S/C11H22O2/c1-11(8-12-2,9-13-3)10-6-4-5-7-10/h10H,4-9H2,1-3H3
InChIKeyYQVKSUDMYCYNTH-UHFFFAOYSA-N
MW186.29 g/mol
LogP2.48
Rot. Bonds5

About (1,3-dimethoxy-2-methylpropan-2-yl)cyclopentane

(1,3-dimethoxy-2-methylpropan-2-yl)cyclopentane (PubChem CID 89106500) has the molecular formula C11H22O2 and a molecular weight of 186.29 g/mol. Its IUPAC name is (1,3-dimethoxy-2-methylpropan-2-yl)cyclopentane.

Molecular Properties

Compound Name(1,3-dimethoxy-2-methylpropan-2-yl)cyclopentane
PubChem CID89106500
Molecular FormulaC11H22O2
Molecular Weight186.29 g/mol
Exact Mass186.16
IUPAC Name(1,3-dimethoxy-2-methylpropan-2-yl)cyclopentane
SMILESCOCC(C)(COC)C1CCCC1
InChIInChI=1S/C11H22O2/c1-11(8-12-2,9-13-3)10-6-4-5-7-10/h10H,4-9H2,1-3H3
InChIKeyYQVKSUDMYCYNTH-UHFFFAOYSA-N
XLogP2.48
TPSA18.46 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds5
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500186.29
LogP ≤ 52.48
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of (1,3-dimethoxy-2-methylpropan-2-yl)cyclopentane?
The IUPAC name of (1,3-dimethoxy-2-methylpropan-2-yl)cyclopentane (CID 89106500) is (1,3-dimethoxy-2-methylpropan-2-yl)cyclopentane.
What is the SMILES notation for (1,3-dimethoxy-2-methylpropan-2-yl)cyclopentane?
The canonical SMILES for (1,3-dimethoxy-2-methylpropan-2-yl)cyclopentane is COCC(C)(COC)C1CCCC1.
What is the InChIKey of (1,3-dimethoxy-2-methylpropan-2-yl)cyclopentane?
The InChIKey is YQVKSUDMYCYNTH-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H22O2/c1-11(8-12-2,9-13-3)10-6-4-5-7-10/h10H,4-9H2,1-3H3.
What are the key properties of (1,3-dimethoxy-2-methylpropan-2-yl)cyclopentane?
(1,3-dimethoxy-2-methylpropan-2-yl)cyclopentane has a molecular weight of 186.29 g/mol, XLogP of 2.48, 5 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for (1,3-dimethoxy-2-methylpropan-2-yl)cyclopentane is sourced from PubChem (CID 89106500), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).