1-(furan-2-ylmethyl)-N-[(3-propyl-1,2-oxazol-5-yl)methyl]piperidine-4-carboxamide

C18H25N3O3 — CID 72847764

IUPAC1-(furan-2-ylmethyl)-N-[(3-propyl-1,2-oxazol-5-yl)methyl]piperidine-4-carboxamide
SMILESCCCc1cc(CNC(=O)C2CCN(Cc3ccco3)CC2)on1
InChIInChI=1S/C18H25N3O3/c1-2-4-15-11-17(24-20-15)12-19-18(22)14-6-8-21(9-7-14)13-16-5-3-10-23-16/h3,5,10-11,14H,2,4,6-9,12-13H2,1H3,(H,19,22)
InChIKeyOPBRHJRWNJYTHG-UHFFFAOYSA-N
MW331.42 g/mol
LogP2.75
Rot. Bonds7

About 1-(furan-2-ylmethyl)-N-[(3-propyl-1,2-oxazol-5-yl)methyl]piperidine-4-carboxamide

1-(furan-2-ylmethyl)-N-[(3-propyl-1,2-oxazol-5-yl)methyl]piperidine-4-carboxamide (PubChem CID 72847764) has the molecular formula C18H25N3O3 and a molecular weight of 331.42 g/mol. Its IUPAC name is 1-(furan-2-ylmethyl)-N-[(3-propyl-1,2-oxazol-5-yl)methyl]piperidine-4-carboxamide.

Molecular Properties

Compound Name1-(furan-2-ylmethyl)-N-[(3-propyl-1,2-oxazol-5-yl)methyl]piperidine-4-carboxamide
PubChem CID72847764
Molecular FormulaC18H25N3O3
Molecular Weight331.42 g/mol
Exact Mass331.19
IUPAC Name1-(furan-2-ylmethyl)-N-[(3-propyl-1,2-oxazol-5-yl)methyl]piperidine-4-carboxamide
SMILESCCCc1cc(CNC(=O)C2CCN(Cc3ccco3)CC2)on1
InChIInChI=1S/C18H25N3O3/c1-2-4-15-11-17(24-20-15)12-19-18(22)14-6-8-21(9-7-14)13-16-5-3-10-23-16/h3,5,10-11,14H,2,4,6-9,12-13H2,1H3,(H,19,22)
InChIKeyOPBRHJRWNJYTHG-UHFFFAOYSA-N
XLogP2.75
TPSA71.51 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds7
Heavy Atoms24
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500331.42
LogP ≤ 52.75
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

Analyze 1-(furan-2-ylmethyl)-N-[(3-propyl-1,2-oxazol-5-yl)methyl]piperidine-4-carboxamide with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Frequently Asked Questions

What is the IUPAC name of 1-(furan-2-ylmethyl)-N-[(3-propyl-1,2-oxazol-5-yl)methyl]piperidine-4-carboxamide?
The IUPAC name of 1-(furan-2-ylmethyl)-N-[(3-propyl-1,2-oxazol-5-yl)methyl]piperidine-4-carboxamide (CID 72847764) is 1-(furan-2-ylmethyl)-N-[(3-propyl-1,2-oxazol-5-yl)methyl]piperidine-4-carboxamide.
What is the SMILES notation for 1-(furan-2-ylmethyl)-N-[(3-propyl-1,2-oxazol-5-yl)methyl]piperidine-4-carboxamide?
The canonical SMILES for 1-(furan-2-ylmethyl)-N-[(3-propyl-1,2-oxazol-5-yl)methyl]piperidine-4-carboxamide is CCCc1cc(CNC(=O)C2CCN(Cc3ccco3)CC2)on1.
What is the InChIKey of 1-(furan-2-ylmethyl)-N-[(3-propyl-1,2-oxazol-5-yl)methyl]piperidine-4-carboxamide?
The InChIKey is OPBRHJRWNJYTHG-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H25N3O3/c1-2-4-15-11-17(24-20-15)12-19-18(22)14-6-8-21(9-7-14)13-16-5-3-10-23-16/h3,5,10-11,14H,2,4,6-9,12-13H2,1H3,(H,19,22).
What are the key properties of 1-(furan-2-ylmethyl)-N-[(3-propyl-1,2-oxazol-5-yl)methyl]piperidine-4-carboxamide?
1-(furan-2-ylmethyl)-N-[(3-propyl-1,2-oxazol-5-yl)methyl]piperidine-4-carboxamide has a molecular weight of 331.42 g/mol, XLogP of 2.75, 7 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(furan-2-ylmethyl)-N-[(3-propyl-1,2-oxazol-5-yl)methyl]piperidine-4-carboxamide is sourced from PubChem (CID 72847764), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).