N-[(2R)-1-amino-4-phenylbutan-2-yl]-2-phenylbenzamide

C23H24N2O — CID 68727278

IUPACN-[(2R)-1-amino-4-phenylbutan-2-yl]-2-phenylbenzamide
SMILESNC[C@@H](CCc1ccccc1)NC(=O)c1ccccc1-c1ccccc1
InChIInChI=1S/C23H24N2O/c24-17-20(16-15-18-9-3-1-4-10-18)25-23(26)22-14-8-7-13-21(22)19-11-5-2-6-12-19/h1-14,20H,15-17,24H2,(H,25,26)/t20-/m1/s1
InChIKeyVGTHWRMPUYXRFQ-HXUWFJFHSA-N
MW344.46 g/mol
LogP4.04
Rot. Bonds7

About N-[(2R)-1-amino-4-phenylbutan-2-yl]-2-phenylbenzamide

N-[(2R)-1-amino-4-phenylbutan-2-yl]-2-phenylbenzamide (PubChem CID 68727278) has the molecular formula C23H24N2O and a molecular weight of 344.46 g/mol. Its IUPAC name is N-[(2R)-1-amino-4-phenylbutan-2-yl]-2-phenylbenzamide.

Molecular Properties

Compound NameN-[(2R)-1-amino-4-phenylbutan-2-yl]-2-phenylbenzamide
PubChem CID68727278
Molecular FormulaC23H24N2O
Molecular Weight344.46 g/mol
Exact Mass344.19
IUPAC NameN-[(2R)-1-amino-4-phenylbutan-2-yl]-2-phenylbenzamide
SMILESNC[C@@H](CCc1ccccc1)NC(=O)c1ccccc1-c1ccccc1
InChIInChI=1S/C23H24N2O/c24-17-20(16-15-18-9-3-1-4-10-18)25-23(26)22-14-8-7-13-21(22)19-11-5-2-6-12-19/h1-14,20H,15-17,24H2,(H,25,26)/t20-/m1/s1
InChIKeyVGTHWRMPUYXRFQ-HXUWFJFHSA-N
XLogP4.04
TPSA55.12 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds7
Heavy Atoms26
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500344.46
LogP ≤ 54.04
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Related Compounds

N-[(2R)-1-amino-3-phenylpropan-2-yl]-2-phenylbenzamide
CID 68724752
N-(1-amino-1-oxo-4-phenylbutan-2-yl)-2-phenylbenzamide
CID 68725551
N-[5-amino-1-oxo-1-(2-phenylethylamino)pentan-2-yl]-2-phenylbenzamide
CID 123327979
N-[(2S)-1-amino-3-methylbutan-2-yl]-2-phenylbenzamide
CID 68724562
N-(1-amino-3-phenylpropan-2-yl)-2-(hydroxymethyl)benzamide
CID 70473357
N-[(2S)-4-amino-3,4-dioxo-1-phenylbutan-2-yl]-2-phenylbenzamide
CID 54553924
N-(1-amino-4-phenylbutan-2-yl)-N-methyl-2-phenylbenzamide
CID 68727121
N-(1-amino-4-phenylbutan-2-yl)-2-methyl-5-phenyl-1,3-thiazole-4-carboxamide
CID 68726589
N-(1-hydroxy-4-methylpentan-2-yl)-2-phenylbenzamide
CID 131985605
N-(1-aminohexan-2-yl)-2-benzylbenzamide
CID 119666866
2-amino-N-(1,5-diphenylpentan-3-yl)acetamide
CID 119340752
(2S)-4-benzylsulfanyl-2-[(2-phenylbenzoyl)amino]butanoic acid
CID 149150781

Frequently Asked Questions

What is the IUPAC name of N-[(2R)-1-amino-4-phenylbutan-2-yl]-2-phenylbenzamide?
The IUPAC name of N-[(2R)-1-amino-4-phenylbutan-2-yl]-2-phenylbenzamide (CID 68727278) is N-[(2R)-1-amino-4-phenylbutan-2-yl]-2-phenylbenzamide.
What is the SMILES notation for N-[(2R)-1-amino-4-phenylbutan-2-yl]-2-phenylbenzamide?
The canonical SMILES for N-[(2R)-1-amino-4-phenylbutan-2-yl]-2-phenylbenzamide is NC[C@@H](CCc1ccccc1)NC(=O)c1ccccc1-c1ccccc1.
What is the InChIKey of N-[(2R)-1-amino-4-phenylbutan-2-yl]-2-phenylbenzamide?
The InChIKey is VGTHWRMPUYXRFQ-HXUWFJFHSA-N. The full InChI is InChI=1S/C23H24N2O/c24-17-20(16-15-18-9-3-1-4-10-18)25-23(26)22-14-8-7-13-21(22)19-11-5-2-6-12-19/h1-14,20H,15-17,24H2,(H,25,26)/t20-/m1/s1.
What are the key properties of N-[(2R)-1-amino-4-phenylbutan-2-yl]-2-phenylbenzamide?
N-[(2R)-1-amino-4-phenylbutan-2-yl]-2-phenylbenzamide has a molecular weight of 344.46 g/mol, XLogP of 4.04, 7 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-[(2R)-1-amino-4-phenylbutan-2-yl]-2-phenylbenzamide is sourced from PubChem (CID 68727278), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).