N-[(1R)-1-phenylethyl]-2-[[(S)-phenyl(pyridin-2-yl)methyl]amino]acetamide

C22H23N3O — CID 32725829

IUPACN-[(1R)-1-phenylethyl]-2-[[(S)-phenyl(pyridin-2-yl)methyl]amino]acetamide
SMILESC[C@@H](NC(=O)CN[C@@H](c1ccccc1)c1ccccn1)c1ccccc1
InChIInChI=1S/C22H23N3O/c1-17(18-10-4-2-5-11-18)25-21(26)16-24-22(19-12-6-3-7-13-19)20-14-8-9-15-23-20/h2-15,17,22,24H,16H2,1H3,(H,25,26)/t17-,22+/m1/s1
InChIKeyKSXVGKMQYIHBDE-VGSWGCGISA-N
MW345.45 g/mol
LogP3.64
Rot. Bonds7

About N-[(1R)-1-phenylethyl]-2-[[(S)-phenyl(pyridin-2-yl)methyl]amino]acetamide

N-[(1R)-1-phenylethyl]-2-[[(S)-phenyl(pyridin-2-yl)methyl]amino]acetamide (PubChem CID 32725829) has the molecular formula C22H23N3O and a molecular weight of 345.45 g/mol. Its IUPAC name is N-[(1R)-1-phenylethyl]-2-[[(S)-phenyl(pyridin-2-yl)methyl]amino]acetamide.

Molecular Properties

Compound NameN-[(1R)-1-phenylethyl]-2-[[(S)-phenyl(pyridin-2-yl)methyl]amino]acetamide
PubChem CID32725829
Molecular FormulaC22H23N3O
Molecular Weight345.45 g/mol
Exact Mass345.18
IUPAC NameN-[(1R)-1-phenylethyl]-2-[[(S)-phenyl(pyridin-2-yl)methyl]amino]acetamide
SMILESC[C@@H](NC(=O)CN[C@@H](c1ccccc1)c1ccccn1)c1ccccc1
InChIInChI=1S/C22H23N3O/c1-17(18-10-4-2-5-11-18)25-21(26)16-24-22(19-12-6-3-7-13-19)20-14-8-9-15-23-20/h2-15,17,22,24H,16H2,1H3,(H,25,26)/t17-,22+/m1/s1
InChIKeyKSXVGKMQYIHBDE-VGSWGCGISA-N
XLogP3.64
TPSA54.02 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds7
Heavy Atoms26
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500345.45
LogP ≤ 53.64
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

Analyze N-[(1R)-1-phenylethyl]-2-[[(S)-phenyl(pyridin-2-yl)methyl]amino]acetamide 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

N-[(1R)-1-phenylethyl]-2-[[(R)-phenyl(pyridin-2-yl)methyl]amino]acetamide
CID 32725839
2-[[(S)-phenyl(pyridin-2-yl)methyl]amino]-N-propylacetamide
CID 34156353
2-(propan-2-ylamino)-N-[(1R)-1-pyridin-2-ylethyl]acetamide
CID 81407440
methyl 3-phenyl-2-[[2-[[phenyl(pyridin-2-yl)methyl]amino]acetyl]amino]propanoate
CID 78825131
N-methyl-N-(1-phenylethyl)-2-[[phenyl(pyridin-2-yl)methyl]amino]acetamide
CID 55410573
3-methyl-N-[(S)-phenyl(pyridin-2-yl)methyl]butanamide
CID 36947465
N-[(1R)-1-phenylethyl]-2-[[(1R)-1-phenylethyl]amino]acetamide
CID 7046108
ethyl 2-[[phenyl(pyridin-2-yl)methyl]amino]acetate
CID 60681847
N-[(2-fluorophenyl)methyl]-2-[[(R)-phenyl(pyridin-2-yl)methyl]amino]acetamide
CID 34159063
N-(1-acetylpiperidin-4-yl)-2-[[phenyl(pyridin-2-yl)methyl]amino]acetamide
CID 86911597
2-(benzhydrylamino)-N-[1-(4-fluorophenyl)ethyl]acetamide;oxalic acid
CID 42913580
N-[(1R)-1-pyridin-2-ylethyl]propanamide
CID 59509331

Frequently Asked Questions

What is the IUPAC name of N-[(1R)-1-phenylethyl]-2-[[(S)-phenyl(pyridin-2-yl)methyl]amino]acetamide?
The IUPAC name of N-[(1R)-1-phenylethyl]-2-[[(S)-phenyl(pyridin-2-yl)methyl]amino]acetamide (CID 32725829) is N-[(1R)-1-phenylethyl]-2-[[(S)-phenyl(pyridin-2-yl)methyl]amino]acetamide.
What is the SMILES notation for N-[(1R)-1-phenylethyl]-2-[[(S)-phenyl(pyridin-2-yl)methyl]amino]acetamide?
The canonical SMILES for N-[(1R)-1-phenylethyl]-2-[[(S)-phenyl(pyridin-2-yl)methyl]amino]acetamide is C[C@@H](NC(=O)CN[C@@H](c1ccccc1)c1ccccn1)c1ccccc1.
What is the InChIKey of N-[(1R)-1-phenylethyl]-2-[[(S)-phenyl(pyridin-2-yl)methyl]amino]acetamide?
The InChIKey is KSXVGKMQYIHBDE-VGSWGCGISA-N. The full InChI is InChI=1S/C22H23N3O/c1-17(18-10-4-2-5-11-18)25-21(26)16-24-22(19-12-6-3-7-13-19)20-14-8-9-15-23-20/h2-15,17,22,24H,16H2,1H3,(H,25,26)/t17-,22+/m1/s1.
What are the key properties of N-[(1R)-1-phenylethyl]-2-[[(S)-phenyl(pyridin-2-yl)methyl]amino]acetamide?
N-[(1R)-1-phenylethyl]-2-[[(S)-phenyl(pyridin-2-yl)methyl]amino]acetamide has a molecular weight of 345.45 g/mol, XLogP of 3.64, 7 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-[(1R)-1-phenylethyl]-2-[[(S)-phenyl(pyridin-2-yl)methyl]amino]acetamide is sourced from PubChem (CID 32725829), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).