3-hydroxy-N-[4-(1,3-oxazol-5-yl)phenyl]-3-phenylbutanamide

C19H18N2O3 — CID 90178107

IUPAC3-hydroxy-N-[4-(1,3-oxazol-5-yl)phenyl]-3-phenylbutanamide
SMILESCC(O)(CC(=O)Nc1ccc(-c2cnco2)cc1)c1ccccc1
InChIInChI=1S/C19H18N2O3/c1-19(23,15-5-3-2-4-6-15)11-18(22)21-16-9-7-14(8-10-16)17-12-20-13-24-17/h2-10,12-13,23H,11H2,1H3,(H,21,22)
InChIKeyRBJUEGFHEDLSHV-UHFFFAOYSA-N
MW322.36 g/mol
LogP3.58
Rot. Bonds5

About 3-hydroxy-N-[4-(1,3-oxazol-5-yl)phenyl]-3-phenylbutanamide

3-hydroxy-N-[4-(1,3-oxazol-5-yl)phenyl]-3-phenylbutanamide (PubChem CID 90178107) has the molecular formula C19H18N2O3 and a molecular weight of 322.36 g/mol. Its IUPAC name is 3-hydroxy-N-[4-(1,3-oxazol-5-yl)phenyl]-3-phenylbutanamide.

Molecular Properties

Compound Name3-hydroxy-N-[4-(1,3-oxazol-5-yl)phenyl]-3-phenylbutanamide
PubChem CID90178107
Molecular FormulaC19H18N2O3
Molecular Weight322.36 g/mol
Exact Mass322.13
IUPAC Name3-hydroxy-N-[4-(1,3-oxazol-5-yl)phenyl]-3-phenylbutanamide
SMILESCC(O)(CC(=O)Nc1ccc(-c2cnco2)cc1)c1ccccc1
InChIInChI=1S/C19H18N2O3/c1-19(23,15-5-3-2-4-6-15)11-18(22)21-16-9-7-14(8-10-16)17-12-20-13-24-17/h2-10,12-13,23H,11H2,1H3,(H,21,22)
InChIKeyRBJUEGFHEDLSHV-UHFFFAOYSA-N
XLogP3.58
TPSA75.36 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500322.36
LogP ≤ 53.58
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Related Compounds

2-(tert-butylamino)-N-[4-(1,3-oxazol-5-yl)phenyl]acetamide
CID 78923690
4-[4-(1,3-oxazol-5-yl)anilino]-4-oxobutanoic acid
CID 54866818
2-(2-methylphenyl)-N-[4-(1,3-oxazol-5-yl)phenyl]acetamide
CID 87008248
2,2-dimethyl-N-[4-(1,3-oxazol-5-yl)phenyl]propanamide
CID 2806322
2-methoxy-N-[4-(1,3-oxazol-5-yl)phenyl]acetamide
CID 60812605
2-[benzyl(methyl)amino]-N-[4-(1,3-oxazol-5-yl)phenyl]acetamide
CID 86873274
N-[3-methoxy-4-(1,3-oxazol-5-yl)phenyl]-3-methyl-3-phenylbutanamide
CID 90177469
4-chloro-N-[4-(1,3-oxazol-5-yl)phenyl]butanamide
CID 63307748
3-ethylsulfanyl-N-[4-(1,3-oxazol-5-yl)phenyl]propanamide
CID 87046910
N-[4-(1,3-oxazol-5-yl)phenyl]-2-pyrazol-1-ylacetamide
CID 141085051
5-(tert-butylsulfonylamino)-N-[4-(1,3-oxazol-5-yl)phenyl]pentanamide
CID 20630720
N-[4-(1,3-oxazol-5-yl)phenyl]-2-(prop-2-enylamino)acetamide
CID 79286058

Frequently Asked Questions

What is the IUPAC name of 3-hydroxy-N-[4-(1,3-oxazol-5-yl)phenyl]-3-phenylbutanamide?
The IUPAC name of 3-hydroxy-N-[4-(1,3-oxazol-5-yl)phenyl]-3-phenylbutanamide (CID 90178107) is 3-hydroxy-N-[4-(1,3-oxazol-5-yl)phenyl]-3-phenylbutanamide.
What is the SMILES notation for 3-hydroxy-N-[4-(1,3-oxazol-5-yl)phenyl]-3-phenylbutanamide?
The canonical SMILES for 3-hydroxy-N-[4-(1,3-oxazol-5-yl)phenyl]-3-phenylbutanamide is CC(O)(CC(=O)Nc1ccc(-c2cnco2)cc1)c1ccccc1.
What is the InChIKey of 3-hydroxy-N-[4-(1,3-oxazol-5-yl)phenyl]-3-phenylbutanamide?
The InChIKey is RBJUEGFHEDLSHV-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H18N2O3/c1-19(23,15-5-3-2-4-6-15)11-18(22)21-16-9-7-14(8-10-16)17-12-20-13-24-17/h2-10,12-13,23H,11H2,1H3,(H,21,22).
What are the key properties of 3-hydroxy-N-[4-(1,3-oxazol-5-yl)phenyl]-3-phenylbutanamide?
3-hydroxy-N-[4-(1,3-oxazol-5-yl)phenyl]-3-phenylbutanamide has a molecular weight of 322.36 g/mol, XLogP of 3.58, 5 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 3-hydroxy-N-[4-(1,3-oxazol-5-yl)phenyl]-3-phenylbutanamide is sourced from PubChem (CID 90178107), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).