N-cyclopentyl-3-[1-[3-(3-fluorophenoxy)propanoyl]piperidin-4-yl]-1,2-oxazole-5-carboxamide

C23H28FN3O4 — CID 92568898

IUPACN-cyclopentyl-3-[1-[3-(3-fluorophenoxy)propanoyl]piperidin-4-yl]-1,2-oxazole-5-carboxamide
SMILESO=C(NC1CCCC1)c1cc(C2CCN(C(=O)CCOc3cccc(F)c3)CC2)no1
InChIInChI=1S/C23H28FN3O4/c24-17-4-3-7-19(14-17)30-13-10-22(28)27-11-8-16(9-12-27)20-15-21(31-26-20)23(29)25-18-5-1-2-6-18/h3-4,7,14-16,18H,1-2,5-6,8-13H2,(H,25,29)
InChIKeyQXZBYSUAHPZKEN-UHFFFAOYSA-N
MW429.49 g/mol
LogP3.66
Rot. Bonds7

About N-cyclopentyl-3-[1-[3-(3-fluorophenoxy)propanoyl]piperidin-4-yl]-1,2-oxazole-5-carboxamide

N-cyclopentyl-3-[1-[3-(3-fluorophenoxy)propanoyl]piperidin-4-yl]-1,2-oxazole-5-carboxamide (PubChem CID 92568898) has the molecular formula C23H28FN3O4 and a molecular weight of 429.49 g/mol. Its IUPAC name is N-cyclopentyl-3-[1-[3-(3-fluorophenoxy)propanoyl]piperidin-4-yl]-1,2-oxazole-5-carboxamide.

Molecular Properties

Compound NameN-cyclopentyl-3-[1-[3-(3-fluorophenoxy)propanoyl]piperidin-4-yl]-1,2-oxazole-5-carboxamide
PubChem CID92568898
Molecular FormulaC23H28FN3O4
Molecular Weight429.49 g/mol
Exact Mass429.21
IUPAC NameN-cyclopentyl-3-[1-[3-(3-fluorophenoxy)propanoyl]piperidin-4-yl]-1,2-oxazole-5-carboxamide
SMILESO=C(NC1CCCC1)c1cc(C2CCN(C(=O)CCOc3cccc(F)c3)CC2)no1
InChIInChI=1S/C23H28FN3O4/c24-17-4-3-7-19(14-17)30-13-10-22(28)27-11-8-16(9-12-27)20-15-21(31-26-20)23(29)25-18-5-1-2-6-18/h3-4,7,14-16,18H,1-2,5-6,8-13H2,(H,25,29)
InChIKeyQXZBYSUAHPZKEN-UHFFFAOYSA-N
XLogP3.66
TPSA84.67 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds7
Heavy Atoms31
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500429.49
LogP ≤ 53.66
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

Analyze N-cyclopentyl-3-[1-[3-(3-fluorophenoxy)propanoyl]piperidin-4-yl]-1,2-oxazole-5-carboxamide with MolForge

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

Launch Full Analysis

Related Compounds

3-[1-[(3-fluorophenyl)methyl]piperidin-4-yl]-N-[(3R)-oxan-3-yl]-1,2-oxazole-5-carboxamide
CID 92568609
3-(3-fluorophenoxy)-1-piperidin-1-ylpropan-1-one
CID 60739345
N-cyclohexyl-3-(3-fluorophenyl)-1,2-oxazole-5-carboxamide
CID 46472289
4-(3-fluorophenoxy)-1-[4-(methylamino)piperidin-1-yl]butan-1-one
CID 119563084
3-[1-(3-fluorophenyl)sulfonylpiperidin-4-yl]-N-[(3R)-oxan-3-yl]-1,2-oxazole-5-carboxamide
CID 92569564
3-(3-fluorophenoxy)-1-(3-hydroxypyrrolidin-1-yl)propan-1-one
CID 62916919
3-(3-fluorophenoxy)-1-[(3S)-3-hydroxypiperidin-1-yl]propan-1-one
CID 93041279
N-cyclohexyl-3-[(3S)-1-[2-(3-methoxyphenyl)ethyl]piperidin-3-yl]-1,2-oxazole-5-carboxamide
CID 95811596
2-fluoro-N-[1-(3-phenoxypropanoyl)piperidin-4-yl]benzamide
CID 108549375
N-(oxan-3-yl)-3-[1-(pyridin-3-ylmethyl)piperidin-4-yl]-1,2-oxazole-5-carboxamide
CID 110228833
3-[1-[(4-methoxyphenyl)methyl]piperidin-4-yl]-N-[(3R)-oxan-3-yl]-1,2-oxazole-5-carboxamide
CID 92595796
4-methyl-N-[1-(3-phenoxypropanoyl)piperidin-4-yl]benzamide
CID 108549132

Frequently Asked Questions

What is the IUPAC name of N-cyclopentyl-3-[1-[3-(3-fluorophenoxy)propanoyl]piperidin-4-yl]-1,2-oxazole-5-carboxamide?
The IUPAC name of N-cyclopentyl-3-[1-[3-(3-fluorophenoxy)propanoyl]piperidin-4-yl]-1,2-oxazole-5-carboxamide (CID 92568898) is N-cyclopentyl-3-[1-[3-(3-fluorophenoxy)propanoyl]piperidin-4-yl]-1,2-oxazole-5-carboxamide.
What is the SMILES notation for N-cyclopentyl-3-[1-[3-(3-fluorophenoxy)propanoyl]piperidin-4-yl]-1,2-oxazole-5-carboxamide?
The canonical SMILES for N-cyclopentyl-3-[1-[3-(3-fluorophenoxy)propanoyl]piperidin-4-yl]-1,2-oxazole-5-carboxamide is O=C(NC1CCCC1)c1cc(C2CCN(C(=O)CCOc3cccc(F)c3)CC2)no1.
What is the InChIKey of N-cyclopentyl-3-[1-[3-(3-fluorophenoxy)propanoyl]piperidin-4-yl]-1,2-oxazole-5-carboxamide?
The InChIKey is QXZBYSUAHPZKEN-UHFFFAOYSA-N. The full InChI is InChI=1S/C23H28FN3O4/c24-17-4-3-7-19(14-17)30-13-10-22(28)27-11-8-16(9-12-27)20-15-21(31-26-20)23(29)25-18-5-1-2-6-18/h3-4,7,14-16,18H,1-2,5-6,8-13H2,(H,25,29).
What are the key properties of N-cyclopentyl-3-[1-[3-(3-fluorophenoxy)propanoyl]piperidin-4-yl]-1,2-oxazole-5-carboxamide?
N-cyclopentyl-3-[1-[3-(3-fluorophenoxy)propanoyl]piperidin-4-yl]-1,2-oxazole-5-carboxamide has a molecular weight of 429.49 g/mol, XLogP of 3.66, 7 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N-cyclopentyl-3-[1-[3-(3-fluorophenoxy)propanoyl]piperidin-4-yl]-1,2-oxazole-5-carboxamide is sourced from PubChem (CID 92568898), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).