(2S)-3-amino-N-hydroxy-2-[(4-phenylphenyl)methylamino]propanamide

C16H19N3O2 — CID 59697068

IUPAC(2S)-3-amino-N-hydroxy-2-[(4-phenylphenyl)methylamino]propanamide
SMILESNC[C@H](NCc1ccc(-c2ccccc2)cc1)C(=O)NO
InChIInChI=1S/C16H19N3O2/c17-10-15(16(20)19-21)18-11-12-6-8-14(9-7-12)13-4-2-1-3-5-13/h1-9,15,18,21H,10-11,17H2,(H,19,20)/t15-/m0/s1
InChIKeyURAJVTMAIPKHGY-HNNXBMFYSA-N
MW285.35 g/mol
LogP1.28
Rot. Bonds6

About (2S)-3-amino-N-hydroxy-2-[(4-phenylphenyl)methylamino]propanamide

(2S)-3-amino-N-hydroxy-2-[(4-phenylphenyl)methylamino]propanamide (PubChem CID 59697068) has the molecular formula C16H19N3O2 and a molecular weight of 285.35 g/mol. Its IUPAC name is (2S)-3-amino-N-hydroxy-2-[(4-phenylphenyl)methylamino]propanamide.

Molecular Properties

Compound Name(2S)-3-amino-N-hydroxy-2-[(4-phenylphenyl)methylamino]propanamide
PubChem CID59697068
Molecular FormulaC16H19N3O2
Molecular Weight285.35 g/mol
Exact Mass285.15
IUPAC Name(2S)-3-amino-N-hydroxy-2-[(4-phenylphenyl)methylamino]propanamide
SMILESNC[C@H](NCc1ccc(-c2ccccc2)cc1)C(=O)NO
InChIInChI=1S/C16H19N3O2/c17-10-15(16(20)19-21)18-11-12-6-8-14(9-7-12)13-4-2-1-3-5-13/h1-9,15,18,21H,10-11,17H2,(H,19,20)/t15-/m0/s1
InChIKeyURAJVTMAIPKHGY-HNNXBMFYSA-N
XLogP1.28
TPSA87.38 Ų
H-Bond Donors4
H-Bond Acceptors4
Rotatable Bonds6
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500285.35
LogP ≤ 51.28
H-Bond Donors ≤ 54
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'hydroxamic_acid', 'substructure': 'N/A'}, {'alert_name': 'Oxygen-nitrogen_single_bond', 'substructure': 'N/A'}

Analyze (2S)-3-amino-N-hydroxy-2-[(4-phenylphenyl)methylamino]propanamide with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

(2S)-3-amino-N-hydroxy-2-[[4-[(E)-2-phenylethenyl]phenyl]methylamino]propanamide
CID 59697173
N-hydroxy-3-phenyl-2-[(4-phenylphenyl)methylamino]propanamide
CID 20748988
3-amino-N-hydroxy-2-[(4-phenylphenyl)sulfonylamino]propanamide
CID 58835331
(2R)-2-(benzylamino)-3-(4-phenylphenyl)propanoic acid
CID 121475383
(2S)-3-amino-N-hydroxy-2-[(2-nitrophenyl)methylamino]propanamide
CID 87749363
N-[(2S)-3-amino-1-(hydroxyamino)-1-oxopropan-2-yl]-4-[4-[[(4-fluorophenyl)methylamino]methyl]phenyl]benzamide
CID 87310386
3-methyl-2-[(4-phenylphenyl)methylamino]butanoic acid
CID 43468629
3-methyl-2-[(4-phenylphenyl)methylamino]pentanamide
CID 77328442
N-[4-[[(2S)-3-amino-1-(hydroxyamino)-1-oxopropan-2-yl]amino]-4-oxobutyl]-4-phenylbenzamide
CID 87836455
tert-butyl-[(2S)-3-(hydroxyamino)-3-oxo-2-[[4-(2-phenylethenyl)phenyl]methylamino]propyl]carbamic acid
CID 173064439
N-benzyl-N'-hydroxy-2-[methyl-(4-phenylbenzoyl)amino]propanediamide
CID 89412989
(2S,3R)-N,3-dihydroxy-2-[(4-phenylphenyl)methylamino]butanamide;hydroxylamine;methane;methyl (2S,3R)-3-hydroxy-2-[(4-phenylphenyl)methylamino]butanoate;4-phenylbenzaldehyde;hydrochloride
CID 158451181

Frequently Asked Questions

What is the IUPAC name of (2S)-3-amino-N-hydroxy-2-[(4-phenylphenyl)methylamino]propanamide?
The IUPAC name of (2S)-3-amino-N-hydroxy-2-[(4-phenylphenyl)methylamino]propanamide (CID 59697068) is (2S)-3-amino-N-hydroxy-2-[(4-phenylphenyl)methylamino]propanamide.
What is the SMILES notation for (2S)-3-amino-N-hydroxy-2-[(4-phenylphenyl)methylamino]propanamide?
The canonical SMILES for (2S)-3-amino-N-hydroxy-2-[(4-phenylphenyl)methylamino]propanamide is NC[C@H](NCc1ccc(-c2ccccc2)cc1)C(=O)NO.
What is the InChIKey of (2S)-3-amino-N-hydroxy-2-[(4-phenylphenyl)methylamino]propanamide?
The InChIKey is URAJVTMAIPKHGY-HNNXBMFYSA-N. The full InChI is InChI=1S/C16H19N3O2/c17-10-15(16(20)19-21)18-11-12-6-8-14(9-7-12)13-4-2-1-3-5-13/h1-9,15,18,21H,10-11,17H2,(H,19,20)/t15-/m0/s1.
What are the key properties of (2S)-3-amino-N-hydroxy-2-[(4-phenylphenyl)methylamino]propanamide?
(2S)-3-amino-N-hydroxy-2-[(4-phenylphenyl)methylamino]propanamide has a molecular weight of 285.35 g/mol, XLogP of 1.28, 6 rotatable bonds, 4 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for (2S)-3-amino-N-hydroxy-2-[(4-phenylphenyl)methylamino]propanamide is sourced from PubChem (CID 59697068), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).