2-cyclopentyl-2-(2-methoxyethyl)propane-1,3-diol

C11H22O3 — CID 112570934

IUPAC2-cyclopentyl-2-(2-methoxyethyl)propane-1,3-diol
SMILESCOCCC(CO)(CO)C1CCCC1
InChIInChI=1S/C11H22O3/c1-14-7-6-11(8-12,9-13)10-4-2-3-5-10/h10,12-13H,2-9H2,1H3
InChIKeyNZSULSORVMSEJW-UHFFFAOYSA-N
MW202.29 g/mol
LogP1.18
Rot. Bonds6

About 2-cyclopentyl-2-(2-methoxyethyl)propane-1,3-diol

2-cyclopentyl-2-(2-methoxyethyl)propane-1,3-diol (PubChem CID 112570934) has the molecular formula C11H22O3 and a molecular weight of 202.29 g/mol. Its IUPAC name is 2-cyclopentyl-2-(2-methoxyethyl)propane-1,3-diol.

Molecular Properties

Compound Name2-cyclopentyl-2-(2-methoxyethyl)propane-1,3-diol
PubChem CID112570934
Molecular FormulaC11H22O3
Molecular Weight202.29 g/mol
Exact Mass202.16
IUPAC Name2-cyclopentyl-2-(2-methoxyethyl)propane-1,3-diol
SMILESCOCCC(CO)(CO)C1CCCC1
InChIInChI=1S/C11H22O3/c1-14-7-6-11(8-12,9-13)10-4-2-3-5-10/h10,12-13H,2-9H2,1H3
InChIKeyNZSULSORVMSEJW-UHFFFAOYSA-N
XLogP1.18
TPSA49.69 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds6
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500202.29
LogP ≤ 51.18
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

(4-methoxy-2-methylbutan-2-yl)cyclopentane
CID 172526249
[1-chloro-2-(chloromethyl)-4-(2-methoxyethoxy)butan-2-yl]cyclopentane
CID 112571093
[1-bromo-2-(bromomethyl)-6-methoxyhexan-2-yl]cyclopentane
CID 104650812
2-cyclopentyl-2-(3-ethylsulfonylpropyl)propane-1,3-diol
CID 112570929
2-(1,1-dioxothiolan-3-yl)-2-[2-(3-methoxypropoxy)ethyl]propane-1,3-diol
CID 103185078
(2R)-2-cyclohexyl-2-(2-methoxyethylamino)propan-1-ol
CID 96740613
[4-cyclohexyl-1-methoxy-2-(methoxymethyl)butan-2-yl]cyclohexane
CID 71344559
2-cycloheptyl-2-methoxypropan-1-ol
CID 105442303
2-cycloheptyl-2-methylpropan-1-ol
CID 82936558
2-cyclohexyl-5-methoxy-3-methylpentan-2-ol
CID 114795055
2-cyclopentyl-2-ethylpropane-1,3-diol;bis(2-methylprop-2-enoic acid)
CID 67708962
2-cyclopropyl-5-(2-methoxyethoxy)-2-methylpentan-1-ol
CID 103415301

Frequently Asked Questions

What is the IUPAC name of 2-cyclopentyl-2-(2-methoxyethyl)propane-1,3-diol?
The IUPAC name of 2-cyclopentyl-2-(2-methoxyethyl)propane-1,3-diol (CID 112570934) is 2-cyclopentyl-2-(2-methoxyethyl)propane-1,3-diol.
What is the SMILES notation for 2-cyclopentyl-2-(2-methoxyethyl)propane-1,3-diol?
The canonical SMILES for 2-cyclopentyl-2-(2-methoxyethyl)propane-1,3-diol is COCCC(CO)(CO)C1CCCC1.
What is the InChIKey of 2-cyclopentyl-2-(2-methoxyethyl)propane-1,3-diol?
The InChIKey is NZSULSORVMSEJW-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H22O3/c1-14-7-6-11(8-12,9-13)10-4-2-3-5-10/h10,12-13H,2-9H2,1H3.
What are the key properties of 2-cyclopentyl-2-(2-methoxyethyl)propane-1,3-diol?
2-cyclopentyl-2-(2-methoxyethyl)propane-1,3-diol has a molecular weight of 202.29 g/mol, XLogP of 1.18, 6 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-cyclopentyl-2-(2-methoxyethyl)propane-1,3-diol is sourced from PubChem (CID 112570934), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).