5-(4-cyclopentylphenyl)-4-methylpentanoic acid

C17H24O2 — CID 70538154

IUPAC5-(4-cyclopentylphenyl)-4-methylpentanoic acid
SMILESCC(CCC(=O)O)Cc1ccc(C2CCCC2)cc1
InChIInChI=1S/C17H24O2/c1-13(6-11-17(18)19)12-14-7-9-16(10-8-14)15-4-2-3-5-15/h7-10,13,15H,2-6,11-12H2,1H3,(H,18,19)
InChIKeyRCKVZBXOTSBOQD-UHFFFAOYSA-N
MW260.38 g/mol
LogP4.39
Rot. Bonds6

About 5-(4-cyclopentylphenyl)-4-methylpentanoic acid

5-(4-cyclopentylphenyl)-4-methylpentanoic acid (PubChem CID 70538154) has the molecular formula C17H24O2 and a molecular weight of 260.38 g/mol. Its IUPAC name is 5-(4-cyclopentylphenyl)-4-methylpentanoic acid.

Molecular Properties

Compound Name5-(4-cyclopentylphenyl)-4-methylpentanoic acid
PubChem CID70538154
Molecular FormulaC17H24O2
Molecular Weight260.38 g/mol
Exact Mass260.18
IUPAC Name5-(4-cyclopentylphenyl)-4-methylpentanoic acid
SMILESCC(CCC(=O)O)Cc1ccc(C2CCCC2)cc1
InChIInChI=1S/C17H24O2/c1-13(6-11-17(18)19)12-14-7-9-16(10-8-14)15-4-2-3-5-15/h7-10,13,15H,2-6,11-12H2,1H3,(H,18,19)
InChIKeyRCKVZBXOTSBOQD-UHFFFAOYSA-N
XLogP4.39
TPSA37.30 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds6
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500260.38
LogP ≤ 54.39
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

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Related Compounds

4-(4-cyclohexylphenyl)-3-methylbutanoic acid
CID 116926748
(4S)-4-methyl-5-phenylpentanoic acid
CID 6995676
5-(4-cyclohexylphenyl)-3-methylpentanoic acid
CID 63536343
3-(4-cyclohexylphenyl)-2-methylpropan-1-amine
CID 116924713
4-(4-cyclohexylphenyl)butanoic acid
CID 3041568
(2S)-2-amino-3-(4-cyclopentylphenyl)propanoic acid
CID 68534657
2-(4-cycloheptylphenyl)acetic acid
CID 21484425
4-[(4-cyclopropylphenyl)methylamino]-5-phenylpentanoic acid
CID 122045700
1-(2-chloropropyl)-4-cyclohexylbenzene
CID 82255538
1-(4-cyclohexylphenyl)-N-methylpropan-2-amine
CID 82262296
3-[[4-[(E)-2-(4-cyclohexylphenyl)-4-[4-(2-methylpropyl)phenyl]-4-oxobut-2-enoyl]benzoyl]amino]propanoic acid
CID 23508896
3-(4-cyclohexylphenyl)-4-methylpentanoic acid
CID 52983807

Frequently Asked Questions

What is the IUPAC name of 5-(4-cyclopentylphenyl)-4-methylpentanoic acid?
The IUPAC name of 5-(4-cyclopentylphenyl)-4-methylpentanoic acid (CID 70538154) is 5-(4-cyclopentylphenyl)-4-methylpentanoic acid.
What is the SMILES notation for 5-(4-cyclopentylphenyl)-4-methylpentanoic acid?
The canonical SMILES for 5-(4-cyclopentylphenyl)-4-methylpentanoic acid is CC(CCC(=O)O)Cc1ccc(C2CCCC2)cc1.
What is the InChIKey of 5-(4-cyclopentylphenyl)-4-methylpentanoic acid?
The InChIKey is RCKVZBXOTSBOQD-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H24O2/c1-13(6-11-17(18)19)12-14-7-9-16(10-8-14)15-4-2-3-5-15/h7-10,13,15H,2-6,11-12H2,1H3,(H,18,19).
What are the key properties of 5-(4-cyclopentylphenyl)-4-methylpentanoic acid?
5-(4-cyclopentylphenyl)-4-methylpentanoic acid has a molecular weight of 260.38 g/mol, XLogP of 4.39, 6 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 5-(4-cyclopentylphenyl)-4-methylpentanoic acid is sourced from PubChem (CID 70538154), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).