N-[(1S)-1-[(5S)-3-benzyl-2,5-dihydro-1,2-oxazol-5-yl]-2-phenylethyl]benzamide

C25H24N2O2 — CID 57009017

IUPACN-[(1S)-1-[(5S)-3-benzyl-2,5-dihydro-1,2-oxazol-5-yl]-2-phenylethyl]benzamide
SMILESO=C(N[C@@H](Cc1ccccc1)[C@@H]1C=C(Cc2ccccc2)NO1)c1ccccc1
InChIInChI=1S/C25H24N2O2/c28-25(21-14-8-3-9-15-21)26-23(17-20-12-6-2-7-13-20)24-18-22(27-29-24)16-19-10-4-1-5-11-19/h1-15,18,23-24,27H,16-17H2,(H,26,28)/t23-,24-/m0/s1
InChIKeyWOZSHGNHRSQLIQ-ZEQRLZLVSA-N
MW384.48 g/mol
LogP4.06
Rot. Bonds7

About N-[(1S)-1-[(5S)-3-benzyl-2,5-dihydro-1,2-oxazol-5-yl]-2-phenylethyl]benzamide

N-[(1S)-1-[(5S)-3-benzyl-2,5-dihydro-1,2-oxazol-5-yl]-2-phenylethyl]benzamide (PubChem CID 57009017) has the molecular formula C25H24N2O2 and a molecular weight of 384.48 g/mol. Its IUPAC name is N-[(1S)-1-[(5S)-3-benzyl-2,5-dihydro-1,2-oxazol-5-yl]-2-phenylethyl]benzamide.

Molecular Properties

Compound NameN-[(1S)-1-[(5S)-3-benzyl-2,5-dihydro-1,2-oxazol-5-yl]-2-phenylethyl]benzamide
PubChem CID57009017
Molecular FormulaC25H24N2O2
Molecular Weight384.48 g/mol
Exact Mass384.18
IUPAC NameN-[(1S)-1-[(5S)-3-benzyl-2,5-dihydro-1,2-oxazol-5-yl]-2-phenylethyl]benzamide
SMILESO=C(N[C@@H](Cc1ccccc1)[C@@H]1C=C(Cc2ccccc2)NO1)c1ccccc1
InChIInChI=1S/C25H24N2O2/c28-25(21-14-8-3-9-15-21)26-23(17-20-12-6-2-7-13-20)24-18-22(27-29-24)16-19-10-4-1-5-11-19/h1-15,18,23-24,27H,16-17H2,(H,26,28)/t23-,24-/m0/s1
InChIKeyWOZSHGNHRSQLIQ-ZEQRLZLVSA-N
XLogP4.06
TPSA50.36 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds7
Heavy Atoms29
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500384.48
LogP ≤ 54.06
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

Analyze N-[(1S)-1-[(5S)-3-benzyl-2,5-dihydro-1,2-oxazol-5-yl]-2-phenylethyl]benzamide 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-Benzoyl-L-phenylalaninol
CID 852848
N-(1-Hydroxy-3-Phenylpropan-2-Yl)Benzamide
CID 100005
Aurantiamide
CID 185904
1-N-[(2S,3R)-3-hydroxy-1-phenyl-4-[[(1R)-1-phenylethyl]amino]butan-2-yl]-4-N,4-N-dipropylbenzene-1,4-dicarboxamide
CID 71520866
Benzenepropanamide, alpha-(benzoylamino)-N-[1-(hydroxymethyl)-2-phenylethyl]-, [S-(R*,R*)]-; (alphaS)-alpha-(Benzoylamino)-N-[(1S)-1-(hydroxymethyl)-2-phenylethyl]benzenepropanamide
CID 53463263
Bz(2-F)-Phe(a,b-dehydro)-Phe-ol
CID 145952555
Bz-Phe(a,b-dehydro,3-Me)-Phe-ol
CID 145955319
1,4-Benzenedicarboxamide, N1,N4-bis(2-hydroxy-1-methyl-2-phenylethyl)-
CID 109443
N-[(1S,2S)-2-hydroxy-1-phenylbut-3-enyl]benzamide
CID 11357631
N-(2-Hydroxy-1,2-diphenylethyl)benzamide
CID 12480090
N-[(1S,2R)-3-[[(2R,3S)-3-benzamido-2-hydroxy-4-phenyl-butyl]amino]-1-benzyl-2-hydroxy-propyl]benzamide
CID 481809
N-phenylmethoxy-N-[(1S)-1-phenylprop-2-enyl]benzamide
CID 12167129

Frequently Asked Questions

What is the IUPAC name of N-[(1S)-1-[(5S)-3-benzyl-2,5-dihydro-1,2-oxazol-5-yl]-2-phenylethyl]benzamide?
The IUPAC name of N-[(1S)-1-[(5S)-3-benzyl-2,5-dihydro-1,2-oxazol-5-yl]-2-phenylethyl]benzamide (CID 57009017) is N-[(1S)-1-[(5S)-3-benzyl-2,5-dihydro-1,2-oxazol-5-yl]-2-phenylethyl]benzamide.
What is the SMILES notation for N-[(1S)-1-[(5S)-3-benzyl-2,5-dihydro-1,2-oxazol-5-yl]-2-phenylethyl]benzamide?
The canonical SMILES for N-[(1S)-1-[(5S)-3-benzyl-2,5-dihydro-1,2-oxazol-5-yl]-2-phenylethyl]benzamide is O=C(N[C@@H](Cc1ccccc1)[C@@H]1C=C(Cc2ccccc2)NO1)c1ccccc1.
What is the InChIKey of N-[(1S)-1-[(5S)-3-benzyl-2,5-dihydro-1,2-oxazol-5-yl]-2-phenylethyl]benzamide?
The InChIKey is WOZSHGNHRSQLIQ-ZEQRLZLVSA-N. The full InChI is InChI=1S/C25H24N2O2/c28-25(21-14-8-3-9-15-21)26-23(17-20-12-6-2-7-13-20)24-18-22(27-29-24)16-19-10-4-1-5-11-19/h1-15,18,23-24,27H,16-17H2,(H,26,28)/t23-,24-/m0/s1.
What are the key properties of N-[(1S)-1-[(5S)-3-benzyl-2,5-dihydro-1,2-oxazol-5-yl]-2-phenylethyl]benzamide?
N-[(1S)-1-[(5S)-3-benzyl-2,5-dihydro-1,2-oxazol-5-yl]-2-phenylethyl]benzamide has a molecular weight of 384.48 g/mol, XLogP of 4.06, 7 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-[(1S)-1-[(5S)-3-benzyl-2,5-dihydro-1,2-oxazol-5-yl]-2-phenylethyl]benzamide is sourced from PubChem (CID 57009017), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).