4-[5-(furan-3-yl)-1,3,4-oxadiazol-2-yl]-N-propan-2-ylpiperidine-1-carboxamide

C15H20N4O3 — CID 90543429

IUPAC4-[5-(furan-3-yl)-1,3,4-oxadiazol-2-yl]-N-propan-2-ylpiperidine-1-carboxamide
SMILESCC(C)NC(=O)N1CCC(c2nnc(-c3ccoc3)o2)CC1
InChIInChI=1S/C15H20N4O3/c1-10(2)16-15(20)19-6-3-11(4-7-19)13-17-18-14(22-13)12-5-8-21-9-12/h5,8-11H,3-4,6-7H2,1-2H3,(H,16,20)
InChIKeyHWHJJDNRHNQDMF-UHFFFAOYSA-N
MW304.35 g/mol
LogP2.63
Rot. Bonds3

About 4-[5-(furan-3-yl)-1,3,4-oxadiazol-2-yl]-N-propan-2-ylpiperidine-1-carboxamide

4-[5-(furan-3-yl)-1,3,4-oxadiazol-2-yl]-N-propan-2-ylpiperidine-1-carboxamide (PubChem CID 90543429) has the molecular formula C15H20N4O3 and a molecular weight of 304.35 g/mol. Its IUPAC name is 4-[5-(furan-3-yl)-1,3,4-oxadiazol-2-yl]-N-propan-2-ylpiperidine-1-carboxamide.

Molecular Properties

Compound Name4-[5-(furan-3-yl)-1,3,4-oxadiazol-2-yl]-N-propan-2-ylpiperidine-1-carboxamide
PubChem CID90543429
Molecular FormulaC15H20N4O3
Molecular Weight304.35 g/mol
Exact Mass304.15
IUPAC Name4-[5-(furan-3-yl)-1,3,4-oxadiazol-2-yl]-N-propan-2-ylpiperidine-1-carboxamide
SMILESCC(C)NC(=O)N1CCC(c2nnc(-c3ccoc3)o2)CC1
InChIInChI=1S/C15H20N4O3/c1-10(2)16-15(20)19-6-3-11(4-7-19)13-17-18-14(22-13)12-5-8-21-9-12/h5,8-11H,3-4,6-7H2,1-2H3,(H,16,20)
InChIKeyHWHJJDNRHNQDMF-UHFFFAOYSA-N
XLogP2.63
TPSA84.40 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds3
Heavy Atoms22
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500304.35
LogP ≤ 52.63
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Frequently Asked Questions

What is the IUPAC name of 4-[5-(furan-3-yl)-1,3,4-oxadiazol-2-yl]-N-propan-2-ylpiperidine-1-carboxamide?
The IUPAC name of 4-[5-(furan-3-yl)-1,3,4-oxadiazol-2-yl]-N-propan-2-ylpiperidine-1-carboxamide (CID 90543429) is 4-[5-(furan-3-yl)-1,3,4-oxadiazol-2-yl]-N-propan-2-ylpiperidine-1-carboxamide.
What is the SMILES notation for 4-[5-(furan-3-yl)-1,3,4-oxadiazol-2-yl]-N-propan-2-ylpiperidine-1-carboxamide?
The canonical SMILES for 4-[5-(furan-3-yl)-1,3,4-oxadiazol-2-yl]-N-propan-2-ylpiperidine-1-carboxamide is CC(C)NC(=O)N1CCC(c2nnc(-c3ccoc3)o2)CC1.
What is the InChIKey of 4-[5-(furan-3-yl)-1,3,4-oxadiazol-2-yl]-N-propan-2-ylpiperidine-1-carboxamide?
The InChIKey is HWHJJDNRHNQDMF-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H20N4O3/c1-10(2)16-15(20)19-6-3-11(4-7-19)13-17-18-14(22-13)12-5-8-21-9-12/h5,8-11H,3-4,6-7H2,1-2H3,(H,16,20).
What are the key properties of 4-[5-(furan-3-yl)-1,3,4-oxadiazol-2-yl]-N-propan-2-ylpiperidine-1-carboxamide?
4-[5-(furan-3-yl)-1,3,4-oxadiazol-2-yl]-N-propan-2-ylpiperidine-1-carboxamide has a molecular weight of 304.35 g/mol, XLogP of 2.63, 3 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 4-[5-(furan-3-yl)-1,3,4-oxadiazol-2-yl]-N-propan-2-ylpiperidine-1-carboxamide is sourced from PubChem (CID 90543429), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).