1-[2-[[5-(furan-2-yl)-1,2-oxazol-3-yl]methoxy]acetyl]piperidine-4-carboxamide

C16H19N3O5 — CID 17254280

IUPAC1-[2-[[5-(furan-2-yl)-1,2-oxazol-3-yl]methoxy]acetyl]piperidine-4-carboxamide
SMILESNC(=O)C1CCN(C(=O)COCc2cc(-c3ccco3)on2)CC1
InChIInChI=1S/C16H19N3O5/c17-16(21)11-3-5-19(6-4-11)15(20)10-22-9-12-8-14(24-18-12)13-2-1-7-23-13/h1-2,7-8,11H,3-6,9-10H2,(H2,17,21)
InChIKeyZIKWOKBBZKJDPJ-UHFFFAOYSA-N
MW333.34 g/mol
LogP1.18
Rot. Bonds6

About 1-[2-[[5-(furan-2-yl)-1,2-oxazol-3-yl]methoxy]acetyl]piperidine-4-carboxamide

1-[2-[[5-(furan-2-yl)-1,2-oxazol-3-yl]methoxy]acetyl]piperidine-4-carboxamide (PubChem CID 17254280) has the molecular formula C16H19N3O5 and a molecular weight of 333.34 g/mol. Its IUPAC name is 1-[2-[[5-(furan-2-yl)-1,2-oxazol-3-yl]methoxy]acetyl]piperidine-4-carboxamide.

Molecular Properties

Compound Name1-[2-[[5-(furan-2-yl)-1,2-oxazol-3-yl]methoxy]acetyl]piperidine-4-carboxamide
PubChem CID17254280
Molecular FormulaC16H19N3O5
Molecular Weight333.34 g/mol
Exact Mass333.13
IUPAC Name1-[2-[[5-(furan-2-yl)-1,2-oxazol-3-yl]methoxy]acetyl]piperidine-4-carboxamide
SMILESNC(=O)C1CCN(C(=O)COCc2cc(-c3ccco3)on2)CC1
InChIInChI=1S/C16H19N3O5/c17-16(21)11-3-5-19(6-4-11)15(20)10-22-9-12-8-14(24-18-12)13-2-1-7-23-13/h1-2,7-8,11H,3-6,9-10H2,(H2,17,21)
InChIKeyZIKWOKBBZKJDPJ-UHFFFAOYSA-N
XLogP1.18
TPSA111.80 Ų
H-Bond Donors1
H-Bond Acceptors6
Rotatable Bonds6
Heavy Atoms24
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500333.34
LogP ≤ 51.18
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 106

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Frequently Asked Questions

What is the IUPAC name of 1-[2-[[5-(furan-2-yl)-1,2-oxazol-3-yl]methoxy]acetyl]piperidine-4-carboxamide?
The IUPAC name of 1-[2-[[5-(furan-2-yl)-1,2-oxazol-3-yl]methoxy]acetyl]piperidine-4-carboxamide (CID 17254280) is 1-[2-[[5-(furan-2-yl)-1,2-oxazol-3-yl]methoxy]acetyl]piperidine-4-carboxamide.
What is the SMILES notation for 1-[2-[[5-(furan-2-yl)-1,2-oxazol-3-yl]methoxy]acetyl]piperidine-4-carboxamide?
The canonical SMILES for 1-[2-[[5-(furan-2-yl)-1,2-oxazol-3-yl]methoxy]acetyl]piperidine-4-carboxamide is NC(=O)C1CCN(C(=O)COCc2cc(-c3ccco3)on2)CC1.
What is the InChIKey of 1-[2-[[5-(furan-2-yl)-1,2-oxazol-3-yl]methoxy]acetyl]piperidine-4-carboxamide?
The InChIKey is ZIKWOKBBZKJDPJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H19N3O5/c17-16(21)11-3-5-19(6-4-11)15(20)10-22-9-12-8-14(24-18-12)13-2-1-7-23-13/h1-2,7-8,11H,3-6,9-10H2,(H2,17,21).
What are the key properties of 1-[2-[[5-(furan-2-yl)-1,2-oxazol-3-yl]methoxy]acetyl]piperidine-4-carboxamide?
1-[2-[[5-(furan-2-yl)-1,2-oxazol-3-yl]methoxy]acetyl]piperidine-4-carboxamide has a molecular weight of 333.34 g/mol, XLogP of 1.18, 6 rotatable bonds, 1 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 1-[2-[[5-(furan-2-yl)-1,2-oxazol-3-yl]methoxy]acetyl]piperidine-4-carboxamide is sourced from PubChem (CID 17254280), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).