N-[(1S,2S)-2-amino-1,2-diphenylethyl]pyridine-2-carboxamide

C20H19N3O — CID 102488759

IUPACN-[(1S,2S)-2-amino-1,2-diphenylethyl]pyridine-2-carboxamide
SMILESN[C@@H](c1ccccc1)[C@@H](NC(=O)c1ccccn1)c1ccccc1
InChIInChI=1S/C20H19N3O/c21-18(15-9-3-1-4-10-15)19(16-11-5-2-6-12-16)23-20(24)17-13-7-8-14-22-17/h1-14,18-19H,21H2,(H,23,24)/t18-,19-/m0/s1
InChIKeyVPROLWMSKJZSPA-OALUTQOASA-N
MW317.39 g/mol
LogP3.25
Rot. Bonds5

About N-[(1S,2S)-2-amino-1,2-diphenylethyl]pyridine-2-carboxamide

N-[(1S,2S)-2-amino-1,2-diphenylethyl]pyridine-2-carboxamide (PubChem CID 102488759) has the molecular formula C20H19N3O and a molecular weight of 317.39 g/mol. Its IUPAC name is N-[(1S,2S)-2-amino-1,2-diphenylethyl]pyridine-2-carboxamide.

Molecular Properties

Compound NameN-[(1S,2S)-2-amino-1,2-diphenylethyl]pyridine-2-carboxamide
PubChem CID102488759
Molecular FormulaC20H19N3O
Molecular Weight317.39 g/mol
Exact Mass317.15
IUPAC NameN-[(1S,2S)-2-amino-1,2-diphenylethyl]pyridine-2-carboxamide
SMILESN[C@@H](c1ccccc1)[C@@H](NC(=O)c1ccccn1)c1ccccc1
InChIInChI=1S/C20H19N3O/c21-18(15-9-3-1-4-10-15)19(16-11-5-2-6-12-16)23-20(24)17-13-7-8-14-22-17/h1-14,18-19H,21H2,(H,23,24)/t18-,19-/m0/s1
InChIKeyVPROLWMSKJZSPA-OALUTQOASA-N
XLogP3.25
TPSA68.01 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500317.39
LogP ≤ 53.25
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

N-[(1S)-2-amino-2-oxo-1-phenylethyl]pyridine-2-carboxamide
CID 94572874
N-[phenyl(pyridin-4-yl)methyl]pyridine-2-carboxamide
CID 47007723
N-(1-phenylpropyl)pyridine-2-carboxamide
CID 5305559
N-(2-hydroxy-1,2,2-triphenylethyl)pyridine-2-carboxamide
CID 171976798
tert-butyl N-[(1R,2R)-1,2-diphenyl-2-(pyridine-2-carbonylamino)ethyl]-N-methoxycarbamate
CID 134957711
N-(2-methyl-1-phenylpropyl)pyrazine-2-carboxamide
CID 16564375
2-N,6-N-bis[(1S,2R)-2-hydroxy-1,2-diphenylethyl]pyridine-2,6-dicarboxamide
CID 171379474
N-[3-(1-aminoethyl)phenyl]pyridine-2-carboxamide
CID 16785087
N-[(1R)-1-(3-chlorophenyl)ethyl]pyridine-2-carboxamide
CID 26907996
N-[(1S)-1-(3-chlorophenyl)ethyl]pyridine-2-carboxamide
CID 26907997
N-[(2R)-2-phenylpropyl]pyridine-2-carboxamide
CID 9302014
N-(2-bromo-2-phenylethyl)pyridine-2-carboxamide
CID 114308424

Frequently Asked Questions

What is the IUPAC name of N-[(1S,2S)-2-amino-1,2-diphenylethyl]pyridine-2-carboxamide?
The IUPAC name of N-[(1S,2S)-2-amino-1,2-diphenylethyl]pyridine-2-carboxamide (CID 102488759) is N-[(1S,2S)-2-amino-1,2-diphenylethyl]pyridine-2-carboxamide.
What is the SMILES notation for N-[(1S,2S)-2-amino-1,2-diphenylethyl]pyridine-2-carboxamide?
The canonical SMILES for N-[(1S,2S)-2-amino-1,2-diphenylethyl]pyridine-2-carboxamide is N[C@@H](c1ccccc1)[C@@H](NC(=O)c1ccccn1)c1ccccc1.
What is the InChIKey of N-[(1S,2S)-2-amino-1,2-diphenylethyl]pyridine-2-carboxamide?
The InChIKey is VPROLWMSKJZSPA-OALUTQOASA-N. The full InChI is InChI=1S/C20H19N3O/c21-18(15-9-3-1-4-10-15)19(16-11-5-2-6-12-16)23-20(24)17-13-7-8-14-22-17/h1-14,18-19H,21H2,(H,23,24)/t18-,19-/m0/s1.
What are the key properties of N-[(1S,2S)-2-amino-1,2-diphenylethyl]pyridine-2-carboxamide?
N-[(1S,2S)-2-amino-1,2-diphenylethyl]pyridine-2-carboxamide has a molecular weight of 317.39 g/mol, XLogP of 3.25, 5 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-[(1S,2S)-2-amino-1,2-diphenylethyl]pyridine-2-carboxamide is sourced from PubChem (CID 102488759), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).