(1R)-2,2,3-trimethylcyclopentane-1-carboxylic acid

C9H16O2 — CID 143623982

IUPAC(1R)-2,2,3-trimethylcyclopentane-1-carboxylic acid
SMILESCC1CC[C@@H](C(=O)O)C1(C)C
InChIInChI=1S/C9H16O2/c1-6-4-5-7(8(10)11)9(6,2)3/h6-7H,4-5H2,1-3H3,(H,10,11)/t6?,7-/m0/s1
InChIKeyLYJVKLGSDVKQPY-MLWJPKLSSA-N
MW156.22 g/mol
LogP2.14
Rot. Bonds1

About (1R)-2,2,3-trimethylcyclopentane-1-carboxylic acid

(1R)-2,2,3-trimethylcyclopentane-1-carboxylic acid (PubChem CID 143623982) has the molecular formula C9H16O2 and a molecular weight of 156.22 g/mol. Its IUPAC name is (1R)-2,2,3-trimethylcyclopentane-1-carboxylic acid.

Molecular Properties

Compound Name(1R)-2,2,3-trimethylcyclopentane-1-carboxylic acid
PubChem CID143623982
Molecular FormulaC9H16O2
Molecular Weight156.22 g/mol
Exact Mass156.12
IUPAC Name(1R)-2,2,3-trimethylcyclopentane-1-carboxylic acid
SMILESCC1CC[C@@H](C(=O)O)C1(C)C
InChIInChI=1S/C9H16O2/c1-6-4-5-7(8(10)11)9(6,2)3/h6-7H,4-5H2,1-3H3,(H,10,11)/t6?,7-/m0/s1
InChIKeyLYJVKLGSDVKQPY-MLWJPKLSSA-N
XLogP2.14
TPSA37.30 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds1
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500156.22
LogP ≤ 52.14
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

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Frequently Asked Questions

What is the IUPAC name of (1R)-2,2,3-trimethylcyclopentane-1-carboxylic acid?
The IUPAC name of (1R)-2,2,3-trimethylcyclopentane-1-carboxylic acid (CID 143623982) is (1R)-2,2,3-trimethylcyclopentane-1-carboxylic acid.
What is the SMILES notation for (1R)-2,2,3-trimethylcyclopentane-1-carboxylic acid?
The canonical SMILES for (1R)-2,2,3-trimethylcyclopentane-1-carboxylic acid is CC1CC[C@@H](C(=O)O)C1(C)C.
What is the InChIKey of (1R)-2,2,3-trimethylcyclopentane-1-carboxylic acid?
The InChIKey is LYJVKLGSDVKQPY-MLWJPKLSSA-N. The full InChI is InChI=1S/C9H16O2/c1-6-4-5-7(8(10)11)9(6,2)3/h6-7H,4-5H2,1-3H3,(H,10,11)/t6?,7-/m0/s1.
What are the key properties of (1R)-2,2,3-trimethylcyclopentane-1-carboxylic acid?
(1R)-2,2,3-trimethylcyclopentane-1-carboxylic acid has a molecular weight of 156.22 g/mol, XLogP of 2.14, 1 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for (1R)-2,2,3-trimethylcyclopentane-1-carboxylic acid is sourced from PubChem (CID 143623982), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).