N-[3-[(2R)-1-oxo-1-phenylpropan-2-yl]oxyphenyl]benzamide

C22H19NO3 — CID 977194

IUPACN-[3-[(2R)-1-oxo-1-phenylpropan-2-yl]oxyphenyl]benzamide
SMILESC[C@@H](Oc1cccc(NC(=O)c2ccccc2)c1)C(=O)c1ccccc1
InChIInChI=1S/C22H19NO3/c1-16(21(24)17-9-4-2-5-10-17)26-20-14-8-13-19(15-20)23-22(25)18-11-6-3-7-12-18/h2-16H,1H3,(H,23,25)/t16-/m1/s1
InChIKeyAIGSIKMOIYOLFB-MRXNPFEDSA-N
MW345.40 g/mol
LogP4.59
Rot. Bonds6

About N-[3-[(2R)-1-oxo-1-phenylpropan-2-yl]oxyphenyl]benzamide

N-[3-[(2R)-1-oxo-1-phenylpropan-2-yl]oxyphenyl]benzamide (PubChem CID 977194) has the molecular formula C22H19NO3 and a molecular weight of 345.40 g/mol. Its IUPAC name is N-[3-[(2R)-1-oxo-1-phenylpropan-2-yl]oxyphenyl]benzamide.

Molecular Properties

Compound NameN-[3-[(2R)-1-oxo-1-phenylpropan-2-yl]oxyphenyl]benzamide
PubChem CID977194
Molecular FormulaC22H19NO3
Molecular Weight345.40 g/mol
Exact Mass345.14
IUPAC NameN-[3-[(2R)-1-oxo-1-phenylpropan-2-yl]oxyphenyl]benzamide
SMILESC[C@@H](Oc1cccc(NC(=O)c2ccccc2)c1)C(=O)c1ccccc1
InChIInChI=1S/C22H19NO3/c1-16(21(24)17-9-4-2-5-10-17)26-20-14-8-13-19(15-20)23-22(25)18-11-6-3-7-12-18/h2-16H,1H3,(H,23,25)/t16-/m1/s1
InChIKeyAIGSIKMOIYOLFB-MRXNPFEDSA-N
XLogP4.59
TPSA55.40 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds6
Heavy Atoms26
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500345.40
LogP ≤ 54.59
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

4-bromo-N-[3-[(2S)-1-oxo-1-phenylpropan-2-yl]oxyphenyl]benzamide
CID 1218528
3-methoxy-N-[3-[(2S)-1-(4-methoxyphenyl)-1-oxopropan-2-yl]oxyphenyl]benzamide
CID 1218490
4-chloro-N-[3-[1-(3-chlorophenyl)-1-oxopropan-2-yl]oxyphenyl]benzamide
CID 19645135
4-propan-2-yloxy-N-(3-propan-2-yloxyphenyl)benzamide
CID 17154760
4-methyl-N-(3-propan-2-yloxyphenyl)benzamide
CID 2989293
N-[3-[1-(4-chlorophenyl)-1-oxopropan-2-yl]oxyphenyl]-2-methylbenzamide
CID 19645063
N-[3-[1-(4-methoxyphenyl)-1-oxopropan-2-yl]oxyphenyl]-2-methylbenzamide
CID 5065918
N-[3-[1-(4-methylphenyl)-1-oxopropan-2-yl]oxyphenyl]-3-nitrobenzamide
CID 3888570
N-[3-(2-phenoxyethoxy)phenyl]-3-propan-2-yloxybenzamide
CID 17142503
4-methyl-N-[3-(1-oxo-1-phenylbutan-2-yl)oxyphenyl]benzamide
CID 19645089
3,4-dichloro-N-[4-[(2R)-1-oxo-1-phenylpropan-2-yl]oxyphenyl]benzamide
CID 1218534
4-bromo-N-(3-propan-2-yloxyphenyl)benzamide
CID 54791087

Frequently Asked Questions

What is the IUPAC name of N-[3-[(2R)-1-oxo-1-phenylpropan-2-yl]oxyphenyl]benzamide?
The IUPAC name of N-[3-[(2R)-1-oxo-1-phenylpropan-2-yl]oxyphenyl]benzamide (CID 977194) is N-[3-[(2R)-1-oxo-1-phenylpropan-2-yl]oxyphenyl]benzamide.
What is the SMILES notation for N-[3-[(2R)-1-oxo-1-phenylpropan-2-yl]oxyphenyl]benzamide?
The canonical SMILES for N-[3-[(2R)-1-oxo-1-phenylpropan-2-yl]oxyphenyl]benzamide is C[C@@H](Oc1cccc(NC(=O)c2ccccc2)c1)C(=O)c1ccccc1.
What is the InChIKey of N-[3-[(2R)-1-oxo-1-phenylpropan-2-yl]oxyphenyl]benzamide?
The InChIKey is AIGSIKMOIYOLFB-MRXNPFEDSA-N. The full InChI is InChI=1S/C22H19NO3/c1-16(21(24)17-9-4-2-5-10-17)26-20-14-8-13-19(15-20)23-22(25)18-11-6-3-7-12-18/h2-16H,1H3,(H,23,25)/t16-/m1/s1.
What are the key properties of N-[3-[(2R)-1-oxo-1-phenylpropan-2-yl]oxyphenyl]benzamide?
N-[3-[(2R)-1-oxo-1-phenylpropan-2-yl]oxyphenyl]benzamide has a molecular weight of 345.40 g/mol, XLogP of 4.59, 6 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-[3-[(2R)-1-oxo-1-phenylpropan-2-yl]oxyphenyl]benzamide is sourced from PubChem (CID 977194), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).