1-[[2-[(5-methyl-1,2-oxazol-3-yl)oxy]acetyl]amino]cyclopentane-1-carboxylic acid

C12H16N2O5 — CID 43351058

IUPAC1-[[2-[(5-methyl-1,2-oxazol-3-yl)oxy]acetyl]amino]cyclopentane-1-carboxylic acid
SMILESCc1cc(OCC(=O)NC2(C(=O)O)CCCC2)no1
InChIInChI=1S/C12H16N2O5/c1-8-6-10(14-19-8)18-7-9(15)13-12(11(16)17)4-2-3-5-12/h6H,2-5,7H2,1H3,(H,13,15)(H,16,17)
InChIKeyOZZVSKYQLVXOBW-UHFFFAOYSA-N
MW268.27 g/mol
LogP0.88
Rot. Bonds5

About 1-[[2-[(5-methyl-1,2-oxazol-3-yl)oxy]acetyl]amino]cyclopentane-1-carboxylic acid

1-[[2-[(5-methyl-1,2-oxazol-3-yl)oxy]acetyl]amino]cyclopentane-1-carboxylic acid (PubChem CID 43351058) has the molecular formula C12H16N2O5 and a molecular weight of 268.27 g/mol. Its IUPAC name is 1-[[2-[(5-methyl-1,2-oxazol-3-yl)oxy]acetyl]amino]cyclopentane-1-carboxylic acid.

Molecular Properties

Compound Name1-[[2-[(5-methyl-1,2-oxazol-3-yl)oxy]acetyl]amino]cyclopentane-1-carboxylic acid
PubChem CID43351058
Molecular FormulaC12H16N2O5
Molecular Weight268.27 g/mol
Exact Mass268.11
IUPAC Name1-[[2-[(5-methyl-1,2-oxazol-3-yl)oxy]acetyl]amino]cyclopentane-1-carboxylic acid
SMILESCc1cc(OCC(=O)NC2(C(=O)O)CCCC2)no1
InChIInChI=1S/C12H16N2O5/c1-8-6-10(14-19-8)18-7-9(15)13-12(11(16)17)4-2-3-5-12/h6H,2-5,7H2,1H3,(H,13,15)(H,16,17)
InChIKeyOZZVSKYQLVXOBW-UHFFFAOYSA-N
XLogP0.88
TPSA101.66 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds5
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500268.27
LogP ≤ 50.88
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

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Frequently Asked Questions

What is the IUPAC name of 1-[[2-[(5-methyl-1,2-oxazol-3-yl)oxy]acetyl]amino]cyclopentane-1-carboxylic acid?
The IUPAC name of 1-[[2-[(5-methyl-1,2-oxazol-3-yl)oxy]acetyl]amino]cyclopentane-1-carboxylic acid (CID 43351058) is 1-[[2-[(5-methyl-1,2-oxazol-3-yl)oxy]acetyl]amino]cyclopentane-1-carboxylic acid.
What is the SMILES notation for 1-[[2-[(5-methyl-1,2-oxazol-3-yl)oxy]acetyl]amino]cyclopentane-1-carboxylic acid?
The canonical SMILES for 1-[[2-[(5-methyl-1,2-oxazol-3-yl)oxy]acetyl]amino]cyclopentane-1-carboxylic acid is Cc1cc(OCC(=O)NC2(C(=O)O)CCCC2)no1.
What is the InChIKey of 1-[[2-[(5-methyl-1,2-oxazol-3-yl)oxy]acetyl]amino]cyclopentane-1-carboxylic acid?
The InChIKey is OZZVSKYQLVXOBW-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H16N2O5/c1-8-6-10(14-19-8)18-7-9(15)13-12(11(16)17)4-2-3-5-12/h6H,2-5,7H2,1H3,(H,13,15)(H,16,17).
What are the key properties of 1-[[2-[(5-methyl-1,2-oxazol-3-yl)oxy]acetyl]amino]cyclopentane-1-carboxylic acid?
1-[[2-[(5-methyl-1,2-oxazol-3-yl)oxy]acetyl]amino]cyclopentane-1-carboxylic acid has a molecular weight of 268.27 g/mol, XLogP of 0.88, 5 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 1-[[2-[(5-methyl-1,2-oxazol-3-yl)oxy]acetyl]amino]cyclopentane-1-carboxylic acid is sourced from PubChem (CID 43351058), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).