1-[2-[3-(5-methyl-1,2,4-oxadiazol-3-yl)phenoxy]acetyl]piperidine-3-carboxamide

C17H20N4O4 — CID 78880932

IUPAC1-[2-[3-(5-methyl-1,2,4-oxadiazol-3-yl)phenoxy]acetyl]piperidine-3-carboxamide
SMILESCc1nc(-c2cccc(OCC(=O)N3CCCC(C(N)=O)C3)c2)no1
InChIInChI=1S/C17H20N4O4/c1-11-19-17(20-25-11)12-4-2-6-14(8-12)24-10-15(22)21-7-3-5-13(9-21)16(18)23/h2,4,6,8,13H,3,5,7,9-10H2,1H3,(H2,18,23)
InChIKeyFULPTOIGLOGZDL-UHFFFAOYSA-N
MW344.37 g/mol
LogP1.15
Rot. Bonds5

About 1-[2-[3-(5-methyl-1,2,4-oxadiazol-3-yl)phenoxy]acetyl]piperidine-3-carboxamide

1-[2-[3-(5-methyl-1,2,4-oxadiazol-3-yl)phenoxy]acetyl]piperidine-3-carboxamide (PubChem CID 78880932) has the molecular formula C17H20N4O4 and a molecular weight of 344.37 g/mol. Its IUPAC name is 1-[2-[3-(5-methyl-1,2,4-oxadiazol-3-yl)phenoxy]acetyl]piperidine-3-carboxamide.

Molecular Properties

Compound Name1-[2-[3-(5-methyl-1,2,4-oxadiazol-3-yl)phenoxy]acetyl]piperidine-3-carboxamide
PubChem CID78880932
Molecular FormulaC17H20N4O4
Molecular Weight344.37 g/mol
Exact Mass344.15
IUPAC Name1-[2-[3-(5-methyl-1,2,4-oxadiazol-3-yl)phenoxy]acetyl]piperidine-3-carboxamide
SMILESCc1nc(-c2cccc(OCC(=O)N3CCCC(C(N)=O)C3)c2)no1
InChIInChI=1S/C17H20N4O4/c1-11-19-17(20-25-11)12-4-2-6-14(8-12)24-10-15(22)21-7-3-5-13(9-21)16(18)23/h2,4,6,8,13H,3,5,7,9-10H2,1H3,(H2,18,23)
InChIKeyFULPTOIGLOGZDL-UHFFFAOYSA-N
XLogP1.15
TPSA111.55 Ų
H-Bond Donors1
H-Bond Acceptors6
Rotatable Bonds5
Heavy Atoms25
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500344.37
LogP ≤ 51.15
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 106

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Related Compounds

(3S)-1-[2-(3-methyl-4-nitrophenoxy)acetyl]piperidine-3-carboxamide
CID 8647924
[2-[(3S)-3-carbamoylpiperidin-1-yl]-2-oxoethyl] 2-(3-bromophenoxy)acetate
CID 9018061
[2-[(3R)-3-carbamoylpiperidin-1-yl]-2-oxoethyl] 2-(3,4-dimethylphenoxy)acetate
CID 9492472
1-[[3-(3-methylphenyl)-1,2,4-oxadiazol-5-yl]methyl]piperidine-3-carboxamide
CID 43929866
2-[3-[5-(4-methylphenyl)-1,2,4-oxadiazol-3-yl]phenoxy]-1-morpholin-4-ylethanone
CID 50754150
(3S)-1-[2-(3,5-dichlorophenoxy)acetyl]piperidine-3-carboxamide
CID 38895516
(3S)-1-[4-(3-phenyl-1,2,4-oxadiazol-5-yl)butanoyl]piperidine-3-carboxamide
CID 94176966
[3-(5-methyl-1,2,4-oxadiazol-3-yl)phenyl] N-cyclohexylcarbamate
CID 69174143
2-methoxy-1-[3-[3-(3-methylphenyl)-1,2,4-oxadiazol-5-yl]piperidin-1-yl]ethanone
CID 3879155
2-(4-fluorophenoxy)-1-[3-[4-(5-methyl-1,2,4-oxadiazol-3-yl)triazol-1-yl]piperidin-1-yl]ethanone
CID 91892109
N-[3-(5-methyl-1,2,4-oxadiazol-3-yl)phenyl]piperidine-1-carboxamide
CID 53013614
N-[3-[5-[(3S)-1-[2-(4-methoxyphenoxy)acetyl]piperidin-3-yl]-1,2,4-oxadiazol-3-yl]phenyl]propanamide
CID 92897619

Frequently Asked Questions

What is the IUPAC name of 1-[2-[3-(5-methyl-1,2,4-oxadiazol-3-yl)phenoxy]acetyl]piperidine-3-carboxamide?
The IUPAC name of 1-[2-[3-(5-methyl-1,2,4-oxadiazol-3-yl)phenoxy]acetyl]piperidine-3-carboxamide (CID 78880932) is 1-[2-[3-(5-methyl-1,2,4-oxadiazol-3-yl)phenoxy]acetyl]piperidine-3-carboxamide.
What is the SMILES notation for 1-[2-[3-(5-methyl-1,2,4-oxadiazol-3-yl)phenoxy]acetyl]piperidine-3-carboxamide?
The canonical SMILES for 1-[2-[3-(5-methyl-1,2,4-oxadiazol-3-yl)phenoxy]acetyl]piperidine-3-carboxamide is Cc1nc(-c2cccc(OCC(=O)N3CCCC(C(N)=O)C3)c2)no1.
What is the InChIKey of 1-[2-[3-(5-methyl-1,2,4-oxadiazol-3-yl)phenoxy]acetyl]piperidine-3-carboxamide?
The InChIKey is FULPTOIGLOGZDL-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H20N4O4/c1-11-19-17(20-25-11)12-4-2-6-14(8-12)24-10-15(22)21-7-3-5-13(9-21)16(18)23/h2,4,6,8,13H,3,5,7,9-10H2,1H3,(H2,18,23).
What are the key properties of 1-[2-[3-(5-methyl-1,2,4-oxadiazol-3-yl)phenoxy]acetyl]piperidine-3-carboxamide?
1-[2-[3-(5-methyl-1,2,4-oxadiazol-3-yl)phenoxy]acetyl]piperidine-3-carboxamide has a molecular weight of 344.37 g/mol, XLogP of 1.15, 5 rotatable bonds, 1 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 1-[2-[3-(5-methyl-1,2,4-oxadiazol-3-yl)phenoxy]acetyl]piperidine-3-carboxamide is sourced from PubChem (CID 78880932), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).