2-hydroxy-2-(3-propan-2-ylcyclobutyl)butanoic acid

C11H20O3 — CID 103565467

IUPAC2-hydroxy-2-(3-propan-2-ylcyclobutyl)butanoic acid
SMILESCCC(O)(C(=O)O)C1CC(C(C)C)C1
InChIInChI=1S/C11H20O3/c1-4-11(14,10(12)13)9-5-8(6-9)7(2)3/h7-9,14H,4-6H2,1-3H3,(H,12,13)
InChIKeyYXXTTXQVYVUCQS-UHFFFAOYSA-N
MW200.28 g/mol
LogP1.89
Rot. Bonds4

About 2-hydroxy-2-(3-propan-2-ylcyclobutyl)butanoic acid

2-hydroxy-2-(3-propan-2-ylcyclobutyl)butanoic acid (PubChem CID 103565467) has the molecular formula C11H20O3 and a molecular weight of 200.28 g/mol. Its IUPAC name is 2-hydroxy-2-(3-propan-2-ylcyclobutyl)butanoic acid.

Molecular Properties

Compound Name2-hydroxy-2-(3-propan-2-ylcyclobutyl)butanoic acid
PubChem CID103565467
Molecular FormulaC11H20O3
Molecular Weight200.28 g/mol
Exact Mass200.14
IUPAC Name2-hydroxy-2-(3-propan-2-ylcyclobutyl)butanoic acid
SMILESCCC(O)(C(=O)O)C1CC(C(C)C)C1
InChIInChI=1S/C11H20O3/c1-4-11(14,10(12)13)9-5-8(6-9)7(2)3/h7-9,14H,4-6H2,1-3H3,(H,12,13)
InChIKeyYXXTTXQVYVUCQS-UHFFFAOYSA-N
XLogP1.89
TPSA57.53 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500200.28
LogP ≤ 51.89
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 2-hydroxy-2-(3-propan-2-ylcyclobutyl)butanoic acid?
The IUPAC name of 2-hydroxy-2-(3-propan-2-ylcyclobutyl)butanoic acid (CID 103565467) is 2-hydroxy-2-(3-propan-2-ylcyclobutyl)butanoic acid.
What is the SMILES notation for 2-hydroxy-2-(3-propan-2-ylcyclobutyl)butanoic acid?
The canonical SMILES for 2-hydroxy-2-(3-propan-2-ylcyclobutyl)butanoic acid is CCC(O)(C(=O)O)C1CC(C(C)C)C1.
What is the InChIKey of 2-hydroxy-2-(3-propan-2-ylcyclobutyl)butanoic acid?
The InChIKey is YXXTTXQVYVUCQS-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H20O3/c1-4-11(14,10(12)13)9-5-8(6-9)7(2)3/h7-9,14H,4-6H2,1-3H3,(H,12,13).
What are the key properties of 2-hydroxy-2-(3-propan-2-ylcyclobutyl)butanoic acid?
2-hydroxy-2-(3-propan-2-ylcyclobutyl)butanoic acid has a molecular weight of 200.28 g/mol, XLogP of 1.89, 4 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-hydroxy-2-(3-propan-2-ylcyclobutyl)butanoic acid is sourced from PubChem (CID 103565467), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).