2-cyclohexyloxy-2-phenylacetic acid

C14H18O3 — CID 43424351

IUPAC2-cyclohexyloxy-2-phenylacetic acid
SMILESO=C(O)C(OC1CCCCC1)c1ccccc1
InChIInChI=1S/C14H18O3/c15-14(16)13(11-7-3-1-4-8-11)17-12-9-5-2-6-10-12/h1,3-4,7-8,12-13H,2,5-6,9-10H2,(H,15,16)
InChIKeyGZDPBECKHIKSGX-UHFFFAOYSA-N
MW234.30 g/mol
LogP3.16
Rot. Bonds4

About 2-cyclohexyloxy-2-phenylacetic acid

2-cyclohexyloxy-2-phenylacetic acid (PubChem CID 43424351) has the molecular formula C14H18O3 and a molecular weight of 234.30 g/mol. Its IUPAC name is 2-cyclohexyloxy-2-phenylacetic acid.

Molecular Properties

Compound Name2-cyclohexyloxy-2-phenylacetic acid
PubChem CID43424351
Molecular FormulaC14H18O3
Molecular Weight234.30 g/mol
Exact Mass234.13
IUPAC Name2-cyclohexyloxy-2-phenylacetic acid
SMILESO=C(O)C(OC1CCCCC1)c1ccccc1
InChIInChI=1S/C14H18O3/c15-14(16)13(11-7-3-1-4-8-11)17-12-9-5-2-6-10-12/h1,3-4,7-8,12-13H,2,5-6,9-10H2,(H,15,16)
InChIKeyGZDPBECKHIKSGX-UHFFFAOYSA-N
XLogP3.16
TPSA46.53 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500234.30
LogP ≤ 53.16
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

(2S)-2-cyclopropyloxy-2-phenylacetic acid
CID 167014814
methyl (2R)-2-cyclohexyloxy-2-phenylacetate
CID 45114259
(2R)-2-(2-cycloheptyloxypropanoylamino)-2-phenylacetic acid
CID 119367577
2-cyclopentyloxy-1-(4-hydroxypiperidin-1-yl)-2-phenylethanone
CID 110923625
(3R)-1-[(2S)-2-cyclopentyloxy-2-phenylacetyl]piperidine-3-carboxylic acid
CID 99638949
(2R)-2-cyclopentyloxy-N-[2-(dimethylamino)-2-oxoethyl]-N-methyl-2-phenylacetamide
CID 95601607
(2R)-N-(1-acetylpiperidin-4-yl)-2-cyclopentyloxy-2-phenylacetamide
CID 95304150
4-(2-cyclopentyloxy-2-phenylacetyl)morpholine-2-carboxylic acid
CID 122146208
2-cyclopentyloxy-N-[(1-hydroxycyclopentyl)methyl]-2-phenylacetamide
CID 111332884
dicyclohexyl 2-phenylpropanedioate
CID 130210180
3-cyclohexyloxy-2-phenylpropanoic acid
CID 63075152
(2S)-N-[2-(tert-butylamino)-2-oxoethyl]-2-cyclopentyloxy-2-phenylacetamide
CID 95601592

Frequently Asked Questions

What is the IUPAC name of 2-cyclohexyloxy-2-phenylacetic acid?
The IUPAC name of 2-cyclohexyloxy-2-phenylacetic acid (CID 43424351) is 2-cyclohexyloxy-2-phenylacetic acid.
What is the SMILES notation for 2-cyclohexyloxy-2-phenylacetic acid?
The canonical SMILES for 2-cyclohexyloxy-2-phenylacetic acid is O=C(O)C(OC1CCCCC1)c1ccccc1.
What is the InChIKey of 2-cyclohexyloxy-2-phenylacetic acid?
The InChIKey is GZDPBECKHIKSGX-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H18O3/c15-14(16)13(11-7-3-1-4-8-11)17-12-9-5-2-6-10-12/h1,3-4,7-8,12-13H,2,5-6,9-10H2,(H,15,16).
What are the key properties of 2-cyclohexyloxy-2-phenylacetic acid?
2-cyclohexyloxy-2-phenylacetic acid has a molecular weight of 234.30 g/mol, XLogP of 3.16, 4 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-cyclohexyloxy-2-phenylacetic acid is sourced from PubChem (CID 43424351), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).