2-(1-hydroxy-2,2-dimethylcyclopentyl)propanoic acid

C10H18O3 — CID 79863080

IUPAC2-(1-hydroxy-2,2-dimethylcyclopentyl)propanoic acid
SMILESCC(C(=O)O)C1(O)CCCC1(C)C
InChIInChI=1S/C10H18O3/c1-7(8(11)12)10(13)6-4-5-9(10,2)3/h7,13H,4-6H2,1-3H3,(H,11,12)
InChIKeyADTPACCWQUKSGK-UHFFFAOYSA-N
MW186.25 g/mol
LogP1.65
Rot. Bonds2

About 2-(1-hydroxy-2,2-dimethylcyclopentyl)propanoic acid

2-(1-hydroxy-2,2-dimethylcyclopentyl)propanoic acid (PubChem CID 79863080) has the molecular formula C10H18O3 and a molecular weight of 186.25 g/mol. Its IUPAC name is 2-(1-hydroxy-2,2-dimethylcyclopentyl)propanoic acid.

Molecular Properties

Compound Name2-(1-hydroxy-2,2-dimethylcyclopentyl)propanoic acid
PubChem CID79863080
Molecular FormulaC10H18O3
Molecular Weight186.25 g/mol
Exact Mass186.13
IUPAC Name2-(1-hydroxy-2,2-dimethylcyclopentyl)propanoic acid
SMILESCC(C(=O)O)C1(O)CCCC1(C)C
InChIInChI=1S/C10H18O3/c1-7(8(11)12)10(13)6-4-5-9(10,2)3/h7,13H,4-6H2,1-3H3,(H,11,12)
InChIKeyADTPACCWQUKSGK-UHFFFAOYSA-N
XLogP1.65
TPSA57.53 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500186.25
LogP ≤ 51.65
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Related Compounds

2-(1-hydroxy-2,2-dimethylcyclohexyl)butanoic acid
CID 79852603
2,2-dimethyl-1-(4-methylpentan-2-yl)cyclopentan-1-ol
CID 130519516
2-(4-methylspiro[4.4]nonan-4-yl)propanoic acid
CID 139578291
1-(difluoromethyl)-2,2-dimethylcyclohexan-1-ol
CID 80604395
trans-(1S,2S)-1-methyl-2-propan-2-ylcyclopentane-1,2-diol
CID 130706001
trans-(1R,2R)-1-methyl-2-propan-2-ylcyclopentane-1,2-diol
CID 45096065
(1S)-1,2,2-trimethylcyclopentane-1-carboxylic acid
CID 11805005
2-(1,2,2-trimethylcyclopentyl)pentanoic acid
CID 139578285
1-hydroxy-2,2-dimethylcyclohexane-1-carboxylic acid
CID 79853126
2-(1-hydroxy-4-methylcycloheptyl)propanoic acid
CID 65085394
3-methyl-2-[(1-methylcyclobutyl)amino]butanoic acid
CID 103264847
2-methylpropanoic acid;1-propan-2-ylcyclohexan-1-ol
CID 174748653

Frequently Asked Questions

What is the IUPAC name of 2-(1-hydroxy-2,2-dimethylcyclopentyl)propanoic acid?
The IUPAC name of 2-(1-hydroxy-2,2-dimethylcyclopentyl)propanoic acid (CID 79863080) is 2-(1-hydroxy-2,2-dimethylcyclopentyl)propanoic acid.
What is the SMILES notation for 2-(1-hydroxy-2,2-dimethylcyclopentyl)propanoic acid?
The canonical SMILES for 2-(1-hydroxy-2,2-dimethylcyclopentyl)propanoic acid is CC(C(=O)O)C1(O)CCCC1(C)C.
What is the InChIKey of 2-(1-hydroxy-2,2-dimethylcyclopentyl)propanoic acid?
The InChIKey is ADTPACCWQUKSGK-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H18O3/c1-7(8(11)12)10(13)6-4-5-9(10,2)3/h7,13H,4-6H2,1-3H3,(H,11,12).
What are the key properties of 2-(1-hydroxy-2,2-dimethylcyclopentyl)propanoic acid?
2-(1-hydroxy-2,2-dimethylcyclopentyl)propanoic acid has a molecular weight of 186.25 g/mol, XLogP of 1.65, 2 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(1-hydroxy-2,2-dimethylcyclopentyl)propanoic acid is sourced from PubChem (CID 79863080), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).