2-[[(2S)-2-phenoxypropanoyl]amino]-N-[(1R)-1-phenylethyl]benzamide

C24H24N2O3 — CID 29448293

IUPAC2-[[(2S)-2-phenoxypropanoyl]amino]-N-[(1R)-1-phenylethyl]benzamide
SMILESC[C@H](Oc1ccccc1)C(=O)Nc1ccccc1C(=O)N[C@H](C)c1ccccc1
InChIInChI=1S/C24H24N2O3/c1-17(19-11-5-3-6-12-19)25-24(28)21-15-9-10-16-22(21)26-23(27)18(2)29-20-13-7-4-8-14-20/h3-18H,1-2H3,(H,25,28)(H,26,27)/t17-,18+/m1/s1
InChIKeySQLFRRAYTMNMLL-MSOLQXFVSA-N
MW388.47 g/mol
LogP4.58
Rot. Bonds7

About 2-[[(2S)-2-phenoxypropanoyl]amino]-N-[(1R)-1-phenylethyl]benzamide

2-[[(2S)-2-phenoxypropanoyl]amino]-N-[(1R)-1-phenylethyl]benzamide (PubChem CID 29448293) has the molecular formula C24H24N2O3 and a molecular weight of 388.47 g/mol. Its IUPAC name is 2-[[(2S)-2-phenoxypropanoyl]amino]-N-[(1R)-1-phenylethyl]benzamide.

Molecular Properties

Compound Name2-[[(2S)-2-phenoxypropanoyl]amino]-N-[(1R)-1-phenylethyl]benzamide
PubChem CID29448293
Molecular FormulaC24H24N2O3
Molecular Weight388.47 g/mol
Exact Mass388.18
IUPAC Name2-[[(2S)-2-phenoxypropanoyl]amino]-N-[(1R)-1-phenylethyl]benzamide
SMILESC[C@H](Oc1ccccc1)C(=O)Nc1ccccc1C(=O)N[C@H](C)c1ccccc1
InChIInChI=1S/C24H24N2O3/c1-17(19-11-5-3-6-12-19)25-24(28)21-15-9-10-16-22(21)26-23(27)18(2)29-20-13-7-4-8-14-20/h3-18H,1-2H3,(H,25,28)(H,26,27)/t17-,18+/m1/s1
InChIKeySQLFRRAYTMNMLL-MSOLQXFVSA-N
XLogP4.58
TPSA67.43 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds7
Heavy Atoms29
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500388.47
LogP ≤ 54.58
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

2-[[(2S)-2-(4-methylphenoxy)propanoyl]amino]-N-[(1R)-1-phenylethyl]benzamide
CID 42426832
2-[[(2S)-2-(4-fluorophenoxy)propanoyl]amino]-N-[(1S)-1-phenylethyl]benzamide
CID 26242811
2-[2-(2-methoxyphenoxy)propanoylamino]-N-(1-phenylethyl)benzamide
CID 4943270
N-tert-butyl-2-(2-phenoxypropanoylamino)benzamide
CID 4939976
2-[[(2R)-2-(2,3-dimethylphenoxy)propanoyl]amino]-N-[(1R)-1-phenylethyl]benzamide
CID 38008079
(2S)-2-phenoxy-N-[(1S)-1-phenylethyl]propanamide
CID 835918
2-[[(2R)-2-phenoxypropanoyl]amino]benzamide
CID 1336329
2-[2-[(3-methoxyphenyl)methoxy]propanoylamino]-N-(1-phenylethyl)benzamide
CID 43077572
N-benzyl-2-[[(2R)-2-phenoxypropanoyl]amino]benzamide
CID 7369012
N-(4-fluorophenyl)-2-[[(2R)-2-phenoxypropanoyl]amino]benzamide
CID 7312062
N-(4-anilinophenyl)-2-(2-phenoxypropanoylamino)benzamide
CID 4942074
N-[(1S)-1-phenylethyl]-2-[[(2S)-2-phenylsulfanylpropanoyl]amino]benzamide
CID 126117121

Frequently Asked Questions

What is the IUPAC name of 2-[[(2S)-2-phenoxypropanoyl]amino]-N-[(1R)-1-phenylethyl]benzamide?
The IUPAC name of 2-[[(2S)-2-phenoxypropanoyl]amino]-N-[(1R)-1-phenylethyl]benzamide (CID 29448293) is 2-[[(2S)-2-phenoxypropanoyl]amino]-N-[(1R)-1-phenylethyl]benzamide.
What is the SMILES notation for 2-[[(2S)-2-phenoxypropanoyl]amino]-N-[(1R)-1-phenylethyl]benzamide?
The canonical SMILES for 2-[[(2S)-2-phenoxypropanoyl]amino]-N-[(1R)-1-phenylethyl]benzamide is C[C@H](Oc1ccccc1)C(=O)Nc1ccccc1C(=O)N[C@H](C)c1ccccc1.
What is the InChIKey of 2-[[(2S)-2-phenoxypropanoyl]amino]-N-[(1R)-1-phenylethyl]benzamide?
The InChIKey is SQLFRRAYTMNMLL-MSOLQXFVSA-N. The full InChI is InChI=1S/C24H24N2O3/c1-17(19-11-5-3-6-12-19)25-24(28)21-15-9-10-16-22(21)26-23(27)18(2)29-20-13-7-4-8-14-20/h3-18H,1-2H3,(H,25,28)(H,26,27)/t17-,18+/m1/s1.
What are the key properties of 2-[[(2S)-2-phenoxypropanoyl]amino]-N-[(1R)-1-phenylethyl]benzamide?
2-[[(2S)-2-phenoxypropanoyl]amino]-N-[(1R)-1-phenylethyl]benzamide has a molecular weight of 388.47 g/mol, XLogP of 4.58, 7 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[[(2S)-2-phenoxypropanoyl]amino]-N-[(1R)-1-phenylethyl]benzamide is sourced from PubChem (CID 29448293), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).