5-cyclopentyl-4-hydroxy-2-propylpentanoic acid

C13H24O3 — CID 103159525

IUPAC5-cyclopentyl-4-hydroxy-2-propylpentanoic acid
SMILESCCCC(CC(O)CC1CCCC1)C(=O)O
InChIInChI=1S/C13H24O3/c1-2-5-11(13(15)16)9-12(14)8-10-6-3-4-7-10/h10-12,14H,2-9H2,1H3,(H,15,16)
InChIKeyWDWKFFARAANYDZ-UHFFFAOYSA-N
MW228.33 g/mol
LogP2.82
Rot. Bonds7

About 5-cyclopentyl-4-hydroxy-2-propylpentanoic acid

5-cyclopentyl-4-hydroxy-2-propylpentanoic acid (PubChem CID 103159525) has the molecular formula C13H24O3 and a molecular weight of 228.33 g/mol. Its IUPAC name is 5-cyclopentyl-4-hydroxy-2-propylpentanoic acid.

Molecular Properties

Compound Name5-cyclopentyl-4-hydroxy-2-propylpentanoic acid
PubChem CID103159525
Molecular FormulaC13H24O3
Molecular Weight228.33 g/mol
Exact Mass228.17
IUPAC Name5-cyclopentyl-4-hydroxy-2-propylpentanoic acid
SMILESCCCC(CC(O)CC1CCCC1)C(=O)O
InChIInChI=1S/C13H24O3/c1-2-5-11(13(15)16)9-12(14)8-10-6-3-4-7-10/h10-12,14H,2-9H2,1H3,(H,15,16)
InChIKeyWDWKFFARAANYDZ-UHFFFAOYSA-N
XLogP2.82
TPSA57.53 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds7
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500228.33
LogP ≤ 52.82
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Related Compounds

7-cyclopentyl-6-hydroxyheptan-3-one
CID 103159212
2-[(cyclopentylamino)methyl]pentanoic acid
CID 82933542
(2R)-1-cyclohexylbutan-2-ol
CID 59949714
1-cycloheptyloctan-2-ol
CID 115783533
1-cyclopentyl-4-ethylhexane-2,5-diol
CID 103160935
2-(cyclohexylmethyl)-4-hydroxyundecanehydrazide
CID 2832774
1-cyclopentyl-7-methyloctane-2,5-diol
CID 103160953
1-cyclohexyl-6-methylheptane-2,4-diol
CID 173250018
formic acid;2-propylpentanoic acid
CID 87531584
1-[(3R)-3-aminopyrrolidin-1-yl]-2-(cyclopentylmethyl)pentan-1-one
CID 119410735
2-(cyclobutylmethyl)-3-hydroxypropanoic acid
CID 130150360
2-ethylpentanoic acid
CID 30020

Frequently Asked Questions

What is the IUPAC name of 5-cyclopentyl-4-hydroxy-2-propylpentanoic acid?
The IUPAC name of 5-cyclopentyl-4-hydroxy-2-propylpentanoic acid (CID 103159525) is 5-cyclopentyl-4-hydroxy-2-propylpentanoic acid.
What is the SMILES notation for 5-cyclopentyl-4-hydroxy-2-propylpentanoic acid?
The canonical SMILES for 5-cyclopentyl-4-hydroxy-2-propylpentanoic acid is CCCC(CC(O)CC1CCCC1)C(=O)O.
What is the InChIKey of 5-cyclopentyl-4-hydroxy-2-propylpentanoic acid?
The InChIKey is WDWKFFARAANYDZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H24O3/c1-2-5-11(13(15)16)9-12(14)8-10-6-3-4-7-10/h10-12,14H,2-9H2,1H3,(H,15,16).
What are the key properties of 5-cyclopentyl-4-hydroxy-2-propylpentanoic acid?
5-cyclopentyl-4-hydroxy-2-propylpentanoic acid has a molecular weight of 228.33 g/mol, XLogP of 2.82, 7 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 5-cyclopentyl-4-hydroxy-2-propylpentanoic acid is sourced from PubChem (CID 103159525), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).