2-cyclopentyloxy-2-ethylbutanoic acid

C11H20O3 — CID 114987710

IUPAC2-cyclopentyloxy-2-ethylbutanoic acid
SMILESCCC(CC)(OC1CCCC1)C(=O)O
InChIInChI=1S/C11H20O3/c1-3-11(4-2,10(12)13)14-9-7-5-6-8-9/h9H,3-8H2,1-2H3,(H,12,13)
InChIKeyLTDQYFWMQLNXGQ-UHFFFAOYSA-N
MW200.28 g/mol
LogP2.59
Rot. Bonds5

About 2-cyclopentyloxy-2-ethylbutanoic acid

2-cyclopentyloxy-2-ethylbutanoic acid (PubChem CID 114987710) has the molecular formula C11H20O3 and a molecular weight of 200.28 g/mol. Its IUPAC name is 2-cyclopentyloxy-2-ethylbutanoic acid.

Molecular Properties

Compound Name2-cyclopentyloxy-2-ethylbutanoic acid
PubChem CID114987710
Molecular FormulaC11H20O3
Molecular Weight200.28 g/mol
Exact Mass200.14
IUPAC Name2-cyclopentyloxy-2-ethylbutanoic acid
SMILESCCC(CC)(OC1CCCC1)C(=O)O
InChIInChI=1S/C11H20O3/c1-3-11(4-2,10(12)13)14-9-7-5-6-8-9/h9H,3-8H2,1-2H3,(H,12,13)
InChIKeyLTDQYFWMQLNXGQ-UHFFFAOYSA-N
XLogP2.59
TPSA46.53 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds5
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500200.28
LogP ≤ 52.59
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

2-(3-carboxypentan-3-ylperoxy)-2-ethylbutanoic acid
CID 141153642
2-cyclohexyloxy-2-cyclopropylpropanoic acid
CID 82238646
dipropyl 2,3-dicyclohexyloxy-2,3-diethylbutanedioate
CID 139989306
2-cycloheptyloxy-4-methoxy-2-methylbutanoic acid
CID 114999950
2-cyclopentyloxy-2,5-dimethylhexanoic acid
CID 114988575
2-cyclobutyloxy-3-methoxy-2-methylpropanoic acid
CID 114997758
tricyclohexyl propane-1,1,1-tricarboxylate
CID 141164819
2-(cyclopentylmethyl)-2-methylbutanoic acid
CID 62740428
2-cyclobutyloxy-2,4-dimethylpentanoic acid
CID 114995104
2-ethyl-2-methoxyoctadecanoic acid
CID 174934080
dipentyl 2,3-dicyclohexyloxy-2,3-diethylbutanedioate
CID 139989336
2-amino-5-cycloheptyloxy-2-ethylpentanoic acid
CID 106806735

Frequently Asked Questions

What is the IUPAC name of 2-cyclopentyloxy-2-ethylbutanoic acid?
The IUPAC name of 2-cyclopentyloxy-2-ethylbutanoic acid (CID 114987710) is 2-cyclopentyloxy-2-ethylbutanoic acid.
What is the SMILES notation for 2-cyclopentyloxy-2-ethylbutanoic acid?
The canonical SMILES for 2-cyclopentyloxy-2-ethylbutanoic acid is CCC(CC)(OC1CCCC1)C(=O)O.
What is the InChIKey of 2-cyclopentyloxy-2-ethylbutanoic acid?
The InChIKey is LTDQYFWMQLNXGQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H20O3/c1-3-11(4-2,10(12)13)14-9-7-5-6-8-9/h9H,3-8H2,1-2H3,(H,12,13).
What are the key properties of 2-cyclopentyloxy-2-ethylbutanoic acid?
2-cyclopentyloxy-2-ethylbutanoic acid has a molecular weight of 200.28 g/mol, XLogP of 2.59, 5 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-cyclopentyloxy-2-ethylbutanoic acid is sourced from PubChem (CID 114987710), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).