2-[(1R)-2-phenylcyclopent-2-en-1-yl]acetic acid

C13H14O2 — CID 131567740

IUPAC2-[(1R)-2-phenylcyclopent-2-en-1-yl]acetic acid
SMILESO=C(O)C[C@H]1CCC=C1c1ccccc1
InChIInChI=1S/C13H14O2/c14-13(15)9-11-7-4-8-12(11)10-5-2-1-3-6-10/h1-3,5-6,8,11H,4,7,9H2,(H,14,15)/t11-/m1/s1
InChIKeyMAWDRUFWVLOSQW-LLVKDONJSA-N
MW202.25 g/mol
LogP2.95
Rot. Bonds3

About 2-[(1R)-2-phenylcyclopent-2-en-1-yl]acetic acid

2-[(1R)-2-phenylcyclopent-2-en-1-yl]acetic acid (PubChem CID 131567740) has the molecular formula C13H14O2 and a molecular weight of 202.25 g/mol. Its IUPAC name is 2-[(1R)-2-phenylcyclopent-2-en-1-yl]acetic acid.

Molecular Properties

Compound Name2-[(1R)-2-phenylcyclopent-2-en-1-yl]acetic acid
PubChem CID131567740
Molecular FormulaC13H14O2
Molecular Weight202.25 g/mol
Exact Mass202.10
IUPAC Name2-[(1R)-2-phenylcyclopent-2-en-1-yl]acetic acid
SMILESO=C(O)C[C@H]1CCC=C1c1ccccc1
InChIInChI=1S/C13H14O2/c14-13(15)9-11-7-4-8-12(11)10-5-2-1-3-6-10/h1-3,5-6,8,11H,4,7,9H2,(H,14,15)/t11-/m1/s1
InChIKeyMAWDRUFWVLOSQW-LLVKDONJSA-N
XLogP2.95
TPSA37.30 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds3
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500202.25
LogP ≤ 52.95
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

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Related Compounds

2-(2-benzhydrylcyclopent-2-en-1-yl)acetic acid
CID 86102600
carbanide;(2-phenylcyclohex-2-en-1-yl)methanol;yttrium
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(1S,2R)-3-phenylcyclohex-3-ene-1,2-diol
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2-(2,5-diphenyl-3,4-dihydropyrazol-4-yl)acetic acid
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2-[(1S)-2-oxo-4-phenylcyclohex-3-en-1-yl]acetic acid
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[6-(methylsulfanylmethyl)cyclohexen-1-yl]benzene
CID 162417225
2-(7-phenyl-1,2,3,4-tetrahydronaphthalen-1-yl)acetic acid
CID 82543452
[(1S,2S)-2-azido-3-phenylcyclohex-3-en-1-yl] acetate
CID 139242894
2-[(1S,4E)-8-oxocyclooct-4-en-1-yl]acetic acid
CID 169300305
(6-fluorocyclohexen-1-yl)benzene
CID 102284062
2-[(1R)-3-[(S)-deuterio-[dimethyl(phenyl)silyl]methyl]cyclohex-3-en-1-yl]acetic acid
CID 25239981
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CID 141041006

Frequently Asked Questions

What is the IUPAC name of 2-[(1R)-2-phenylcyclopent-2-en-1-yl]acetic acid?
The IUPAC name of 2-[(1R)-2-phenylcyclopent-2-en-1-yl]acetic acid (CID 131567740) is 2-[(1R)-2-phenylcyclopent-2-en-1-yl]acetic acid.
What is the SMILES notation for 2-[(1R)-2-phenylcyclopent-2-en-1-yl]acetic acid?
The canonical SMILES for 2-[(1R)-2-phenylcyclopent-2-en-1-yl]acetic acid is O=C(O)C[C@H]1CCC=C1c1ccccc1.
What is the InChIKey of 2-[(1R)-2-phenylcyclopent-2-en-1-yl]acetic acid?
The InChIKey is MAWDRUFWVLOSQW-LLVKDONJSA-N. The full InChI is InChI=1S/C13H14O2/c14-13(15)9-11-7-4-8-12(11)10-5-2-1-3-6-10/h1-3,5-6,8,11H,4,7,9H2,(H,14,15)/t11-/m1/s1.
What are the key properties of 2-[(1R)-2-phenylcyclopent-2-en-1-yl]acetic acid?
2-[(1R)-2-phenylcyclopent-2-en-1-yl]acetic acid has a molecular weight of 202.25 g/mol, XLogP of 2.95, 3 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[(1R)-2-phenylcyclopent-2-en-1-yl]acetic acid is sourced from PubChem (CID 131567740), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).