2-[1-[[5-(2-propoxyethyl)-1,3,4-oxadiazol-2-yl]methyl]cyclopentyl]acetic acid

C15H24N2O4 — CID 62716683

IUPAC2-[1-[[5-(2-propoxyethyl)-1,3,4-oxadiazol-2-yl]methyl]cyclopentyl]acetic acid
SMILESCCCOCCc1nnc(CC2(CC(=O)O)CCCC2)o1
InChIInChI=1S/C15H24N2O4/c1-2-8-20-9-5-12-16-17-13(21-12)10-15(11-14(18)19)6-3-4-7-15/h2-11H2,1H3,(H,18,19)
InChIKeyWWBXGNNOBUZAKB-UHFFFAOYSA-N
MW296.37 g/mol
LogP2.62
Rot. Bonds9

About 2-[1-[[5-(2-propoxyethyl)-1,3,4-oxadiazol-2-yl]methyl]cyclopentyl]acetic acid

2-[1-[[5-(2-propoxyethyl)-1,3,4-oxadiazol-2-yl]methyl]cyclopentyl]acetic acid (PubChem CID 62716683) has the molecular formula C15H24N2O4 and a molecular weight of 296.37 g/mol. Its IUPAC name is 2-[1-[[5-(2-propoxyethyl)-1,3,4-oxadiazol-2-yl]methyl]cyclopentyl]acetic acid.

Molecular Properties

Compound Name2-[1-[[5-(2-propoxyethyl)-1,3,4-oxadiazol-2-yl]methyl]cyclopentyl]acetic acid
PubChem CID62716683
Molecular FormulaC15H24N2O4
Molecular Weight296.37 g/mol
Exact Mass296.17
IUPAC Name2-[1-[[5-(2-propoxyethyl)-1,3,4-oxadiazol-2-yl]methyl]cyclopentyl]acetic acid
SMILESCCCOCCc1nnc(CC2(CC(=O)O)CCCC2)o1
InChIInChI=1S/C15H24N2O4/c1-2-8-20-9-5-12-16-17-13(21-12)10-15(11-14(18)19)6-3-4-7-15/h2-11H2,1H3,(H,18,19)
InChIKeyWWBXGNNOBUZAKB-UHFFFAOYSA-N
XLogP2.62
TPSA85.45 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds9
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500296.37
LogP ≤ 52.62
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Aliphatic_long_chain', 'substructure': 'N/A'}

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Related Compounds

3-methyl-4-[5-(2-propoxyethyl)-1,3,4-oxadiazol-2-yl]butanoic acid
CID 62965360
2-[1-[(3-propyl-1,2,4-oxadiazol-5-yl)methyl]cyclopentyl]acetic acid
CID 59912914
2-[1-[(3-propoxypropanoylamino)methyl]cyclobutyl]acetic acid
CID 81164500
2-[1-[(5-pyridin-4-yl-1,3,4-oxadiazol-2-yl)methyl]cyclopentyl]acetic acid
CID 61071529
2-[1-[[5-(5-bromofuran-2-yl)-1,3,4-oxadiazol-2-yl]methyl]cyclopentyl]acetic acid
CID 61071152
2-[1-[(5-thiophen-3-yl-1,3,4-oxadiazol-2-yl)methyl]cyclopentyl]acetic acid
CID 61071712
2-[1-[(5-methyl-4-propyl-1,2,4-triazol-3-yl)methyl]cyclohexyl]acetic acid
CID 61376083
2-[1-[[3-(methoxymethyl)-1,2,4-oxadiazol-5-yl]methyl]cyclopentyl]acetic acid
CID 54977860
2-[1-[[3-(2-ethoxypropan-2-yl)-1,2,4-oxadiazol-5-yl]methyl]cyclopentyl]acetic acid
CID 116705047
2-[1-(2-butoxy-2-oxoethyl)cyclopentyl]acetic acid
CID 71030728
2-[1-[[3-(2-methoxybutan-2-yl)-1,2,4-oxadiazol-5-yl]methyl]cyclopentyl]acetic acid
CID 116743957
2-methyl-N-[2-[5-(2-propoxyethyl)-1,3,4-oxadiazol-2-yl]ethyl]propan-2-amine
CID 62716856

Frequently Asked Questions

What is the IUPAC name of 2-[1-[[5-(2-propoxyethyl)-1,3,4-oxadiazol-2-yl]methyl]cyclopentyl]acetic acid?
The IUPAC name of 2-[1-[[5-(2-propoxyethyl)-1,3,4-oxadiazol-2-yl]methyl]cyclopentyl]acetic acid (CID 62716683) is 2-[1-[[5-(2-propoxyethyl)-1,3,4-oxadiazol-2-yl]methyl]cyclopentyl]acetic acid.
What is the SMILES notation for 2-[1-[[5-(2-propoxyethyl)-1,3,4-oxadiazol-2-yl]methyl]cyclopentyl]acetic acid?
The canonical SMILES for 2-[1-[[5-(2-propoxyethyl)-1,3,4-oxadiazol-2-yl]methyl]cyclopentyl]acetic acid is CCCOCCc1nnc(CC2(CC(=O)O)CCCC2)o1.
What is the InChIKey of 2-[1-[[5-(2-propoxyethyl)-1,3,4-oxadiazol-2-yl]methyl]cyclopentyl]acetic acid?
The InChIKey is WWBXGNNOBUZAKB-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H24N2O4/c1-2-8-20-9-5-12-16-17-13(21-12)10-15(11-14(18)19)6-3-4-7-15/h2-11H2,1H3,(H,18,19).
What are the key properties of 2-[1-[[5-(2-propoxyethyl)-1,3,4-oxadiazol-2-yl]methyl]cyclopentyl]acetic acid?
2-[1-[[5-(2-propoxyethyl)-1,3,4-oxadiazol-2-yl]methyl]cyclopentyl]acetic acid has a molecular weight of 296.37 g/mol, XLogP of 2.62, 9 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[1-[[5-(2-propoxyethyl)-1,3,4-oxadiazol-2-yl]methyl]cyclopentyl]acetic acid is sourced from PubChem (CID 62716683), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).