N-[1-[4-(2,4-difluorophenoxy)piperidin-1-yl]-1-oxo-3-phenylpropan-2-yl]furan-2-carboxamide

C25H24F2N2O4 — CID 112836615

IUPACN-[1-[4-(2,4-difluorophenoxy)piperidin-1-yl]-1-oxo-3-phenylpropan-2-yl]furan-2-carboxamide
SMILESO=C(NC(Cc1ccccc1)C(=O)N1CCC(Oc2ccc(F)cc2F)CC1)c1ccco1
InChIInChI=1S/C25H24F2N2O4/c26-18-8-9-22(20(27)16-18)33-19-10-12-29(13-11-19)25(31)21(15-17-5-2-1-3-6-17)28-24(30)23-7-4-14-32-23/h1-9,14,16,19,21H,10-13,15H2,(H,28,30)
InChIKeyVIZQXRFXHDVFIW-UHFFFAOYSA-N
MW454.47 g/mol
LogP3.97
Rot. Bonds7

About N-[1-[4-(2,4-difluorophenoxy)piperidin-1-yl]-1-oxo-3-phenylpropan-2-yl]furan-2-carboxamide

N-[1-[4-(2,4-difluorophenoxy)piperidin-1-yl]-1-oxo-3-phenylpropan-2-yl]furan-2-carboxamide (PubChem CID 112836615) has the molecular formula C25H24F2N2O4 and a molecular weight of 454.47 g/mol. Its IUPAC name is N-[1-[4-(2,4-difluorophenoxy)piperidin-1-yl]-1-oxo-3-phenylpropan-2-yl]furan-2-carboxamide.

Molecular Properties

Compound NameN-[1-[4-(2,4-difluorophenoxy)piperidin-1-yl]-1-oxo-3-phenylpropan-2-yl]furan-2-carboxamide
PubChem CID112836615
Molecular FormulaC25H24F2N2O4
Molecular Weight454.47 g/mol
Exact Mass454.17
IUPAC NameN-[1-[4-(2,4-difluorophenoxy)piperidin-1-yl]-1-oxo-3-phenylpropan-2-yl]furan-2-carboxamide
SMILESO=C(NC(Cc1ccccc1)C(=O)N1CCC(Oc2ccc(F)cc2F)CC1)c1ccco1
InChIInChI=1S/C25H24F2N2O4/c26-18-8-9-22(20(27)16-18)33-19-10-12-29(13-11-19)25(31)21(15-17-5-2-1-3-6-17)28-24(30)23-7-4-14-32-23/h1-9,14,16,19,21H,10-13,15H2,(H,28,30)
InChIKeyVIZQXRFXHDVFIW-UHFFFAOYSA-N
XLogP3.97
TPSA71.78 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds7
Heavy Atoms33
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500454.47
LogP ≤ 53.97
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

Analyze N-[1-[4-(2,4-difluorophenoxy)piperidin-1-yl]-1-oxo-3-phenylpropan-2-yl]furan-2-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

N-[1-[4-(cyclobutylamino)piperidin-1-yl]-1-oxo-3-phenylpropan-2-yl]furan-2-carboxamide
CID 166257021
N-[1-oxo-3-phenyl-1-(4-phenylpiperidin-1-yl)propan-2-yl]furan-2-carboxamide
CID 55550533
ethyl 1-[2-(furan-2-carbonylamino)-3-phenylpropanoyl]piperidine-4-carboxylate
CID 78780464
N-[1-[4-(2,4-difluorophenoxy)piperidin-1-yl]-3-(1H-indol-3-yl)-1-oxopropan-2-yl]acetamide
CID 112843422
2,4-difluoro-N-(1-oxo-3-phenyl-1-pyrrolidin-1-ylpropan-2-yl)benzamide
CID 51130305
N-[(2R)-1-[4-(1,3-benzoxazol-2-yl)piperidin-1-yl]-1-oxo-3-phenylpropan-2-yl]furan-2-carboxamide
CID 41210107
N-[1-[4-[(2-methoxy-5-methylphenyl)methyl]piperazin-1-yl]-1-oxo-3-phenylpropan-2-yl]furan-2-carboxamide
CID 17433135
N-[(2S)-1-(4-benzylsulfonylpiperazin-1-yl)-1-oxo-3-phenylpropan-2-yl]furan-2-carboxamide
CID 41138290
N-[1-[4-(3-chlorophenyl)piperazin-1-yl]-1-oxo-3-phenylpropan-2-yl]furan-2-carboxamide
CID 46559911
4-chloro-N-[1-[4-(2,4-difluorophenoxy)piperidin-1-yl]-3-methyl-1-oxobutan-2-yl]benzamide
CID 112836632
2-amino-1-[4-(2,4-difluorophenoxy)piperidin-1-yl]-3-methoxypropan-1-one;hydrochloride
CID 120986431
N-[(2R)-1-[(1-benzoylpiperidin-4-yl)amino]-1-oxo-3-phenylpropan-2-yl]furan-2-carboxamide
CID 51728586

Frequently Asked Questions

What is the IUPAC name of N-[1-[4-(2,4-difluorophenoxy)piperidin-1-yl]-1-oxo-3-phenylpropan-2-yl]furan-2-carboxamide?
The IUPAC name of N-[1-[4-(2,4-difluorophenoxy)piperidin-1-yl]-1-oxo-3-phenylpropan-2-yl]furan-2-carboxamide (CID 112836615) is N-[1-[4-(2,4-difluorophenoxy)piperidin-1-yl]-1-oxo-3-phenylpropan-2-yl]furan-2-carboxamide.
What is the SMILES notation for N-[1-[4-(2,4-difluorophenoxy)piperidin-1-yl]-1-oxo-3-phenylpropan-2-yl]furan-2-carboxamide?
The canonical SMILES for N-[1-[4-(2,4-difluorophenoxy)piperidin-1-yl]-1-oxo-3-phenylpropan-2-yl]furan-2-carboxamide is O=C(NC(Cc1ccccc1)C(=O)N1CCC(Oc2ccc(F)cc2F)CC1)c1ccco1.
What is the InChIKey of N-[1-[4-(2,4-difluorophenoxy)piperidin-1-yl]-1-oxo-3-phenylpropan-2-yl]furan-2-carboxamide?
The InChIKey is VIZQXRFXHDVFIW-UHFFFAOYSA-N. The full InChI is InChI=1S/C25H24F2N2O4/c26-18-8-9-22(20(27)16-18)33-19-10-12-29(13-11-19)25(31)21(15-17-5-2-1-3-6-17)28-24(30)23-7-4-14-32-23/h1-9,14,16,19,21H,10-13,15H2,(H,28,30).
What are the key properties of N-[1-[4-(2,4-difluorophenoxy)piperidin-1-yl]-1-oxo-3-phenylpropan-2-yl]furan-2-carboxamide?
N-[1-[4-(2,4-difluorophenoxy)piperidin-1-yl]-1-oxo-3-phenylpropan-2-yl]furan-2-carboxamide has a molecular weight of 454.47 g/mol, XLogP of 3.97, 7 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-[1-[4-(2,4-difluorophenoxy)piperidin-1-yl]-1-oxo-3-phenylpropan-2-yl]furan-2-carboxamide is sourced from PubChem (CID 112836615), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).