(2R)-N-(4-benzoylphenyl)-2-(4-methylphenoxy)propanamide

C23H21NO3 — CID 1019881

IUPAC(2R)-N-(4-benzoylphenyl)-2-(4-methylphenoxy)propanamide
SMILESCc1ccc(O[C@H](C)C(=O)Nc2ccc(C(=O)c3ccccc3)cc2)cc1
InChIInChI=1S/C23H21NO3/c1-16-8-14-21(15-9-16)27-17(2)23(26)24-20-12-10-19(11-13-20)22(25)18-6-4-3-5-7-18/h3-15,17H,1-2H3,(H,24,26)/t17-/m1/s1
InChIKeyXTAVVOHMWNRQKS-QGZVFWFLSA-N
MW359.43 g/mol
LogP4.63
Rot. Bonds6

About (2R)-N-(4-benzoylphenyl)-2-(4-methylphenoxy)propanamide

(2R)-N-(4-benzoylphenyl)-2-(4-methylphenoxy)propanamide (PubChem CID 1019881) has the molecular formula C23H21NO3 and a molecular weight of 359.43 g/mol. Its IUPAC name is (2R)-N-(4-benzoylphenyl)-2-(4-methylphenoxy)propanamide.

Molecular Properties

Compound Name(2R)-N-(4-benzoylphenyl)-2-(4-methylphenoxy)propanamide
PubChem CID1019881
Molecular FormulaC23H21NO3
Molecular Weight359.43 g/mol
Exact Mass359.15
IUPAC Name(2R)-N-(4-benzoylphenyl)-2-(4-methylphenoxy)propanamide
SMILESCc1ccc(O[C@H](C)C(=O)Nc2ccc(C(=O)c3ccccc3)cc2)cc1
InChIInChI=1S/C23H21NO3/c1-16-8-14-21(15-9-16)27-17(2)23(26)24-20-12-10-19(11-13-20)22(25)18-6-4-3-5-7-18/h3-15,17H,1-2H3,(H,24,26)/t17-/m1/s1
InChIKeyXTAVVOHMWNRQKS-QGZVFWFLSA-N
XLogP4.63
TPSA55.40 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds6
Heavy Atoms27
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500359.43
LogP ≤ 54.63
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

N-(4-methylphenyl)-2-phenoxypropanamide
CID 4639701
N-methyl-4-[[(2S)-2-(4-methylphenoxy)propanoyl]amino]benzamide
CID 26906168
4-[[(2S)-2-phenoxypropanoyl]amino]benzoic acid
CID 1365740
3-methyl-N-[4-[2-(4-methylphenoxy)propanoylamino]phenyl]benzamide
CID 17252287
2-(3,4-dimethylphenoxy)-N-(4-methylphenyl)propanamide
CID 53266277
2-(4-chlorophenoxy)-N-(4-methylphenyl)propanamide
CID 4943921
4-[[(2S)-2-(4-phenylphenoxy)propanoyl]amino]benzamide
CID 1177972
ethyl 4-[[(2S)-2-(4-methylphenoxy)propanoyl]amino]benzoate
CID 837427
N-phenyl-2-(4-phenylphenoxy)propanamide
CID 2969640
(2R)-2-(4-methylphenoxy)-N-naphthalen-2-ylpropanamide
CID 837371
[(2R)-1-(4-methylanilino)-1-oxopropan-2-yl] (2S)-2-phenoxypropanoate
CID 7833485
N-(4-acetamidophenyl)-2-phenoxypropanamide
CID 2897872

Frequently Asked Questions

What is the IUPAC name of (2R)-N-(4-benzoylphenyl)-2-(4-methylphenoxy)propanamide?
The IUPAC name of (2R)-N-(4-benzoylphenyl)-2-(4-methylphenoxy)propanamide (CID 1019881) is (2R)-N-(4-benzoylphenyl)-2-(4-methylphenoxy)propanamide.
What is the SMILES notation for (2R)-N-(4-benzoylphenyl)-2-(4-methylphenoxy)propanamide?
The canonical SMILES for (2R)-N-(4-benzoylphenyl)-2-(4-methylphenoxy)propanamide is Cc1ccc(O[C@H](C)C(=O)Nc2ccc(C(=O)c3ccccc3)cc2)cc1.
What is the InChIKey of (2R)-N-(4-benzoylphenyl)-2-(4-methylphenoxy)propanamide?
The InChIKey is XTAVVOHMWNRQKS-QGZVFWFLSA-N. The full InChI is InChI=1S/C23H21NO3/c1-16-8-14-21(15-9-16)27-17(2)23(26)24-20-12-10-19(11-13-20)22(25)18-6-4-3-5-7-18/h3-15,17H,1-2H3,(H,24,26)/t17-/m1/s1.
What are the key properties of (2R)-N-(4-benzoylphenyl)-2-(4-methylphenoxy)propanamide?
(2R)-N-(4-benzoylphenyl)-2-(4-methylphenoxy)propanamide has a molecular weight of 359.43 g/mol, XLogP of 4.63, 6 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for (2R)-N-(4-benzoylphenyl)-2-(4-methylphenoxy)propanamide is sourced from PubChem (CID 1019881), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).