(2S)-2-amino-4-methyl-N-[3-(1,3-oxazol-5-yl)phenyl]pentanamide

C15H19N3O2 — CID 61180352

IUPAC(2S)-2-amino-4-methyl-N-[3-(1,3-oxazol-5-yl)phenyl]pentanamide
SMILESCC(C)C[C@H](N)C(=O)Nc1cccc(-c2cnco2)c1
InChIInChI=1S/C15H19N3O2/c1-10(2)6-13(16)15(19)18-12-5-3-4-11(7-12)14-8-17-9-20-14/h3-5,7-10,13H,6,16H2,1-2H3,(H,18,19)/t13-/m0/s1
InChIKeyMSYBJXNJGLQUFB-ZDUSSCGKSA-N
MW273.34 g/mol
LogP2.65
Rot. Bonds5

About (2S)-2-amino-4-methyl-N-[3-(1,3-oxazol-5-yl)phenyl]pentanamide

(2S)-2-amino-4-methyl-N-[3-(1,3-oxazol-5-yl)phenyl]pentanamide (PubChem CID 61180352) has the molecular formula C15H19N3O2 and a molecular weight of 273.34 g/mol. Its IUPAC name is (2S)-2-amino-4-methyl-N-[3-(1,3-oxazol-5-yl)phenyl]pentanamide.

Molecular Properties

Compound Name(2S)-2-amino-4-methyl-N-[3-(1,3-oxazol-5-yl)phenyl]pentanamide
PubChem CID61180352
Molecular FormulaC15H19N3O2
Molecular Weight273.34 g/mol
Exact Mass273.15
IUPAC Name(2S)-2-amino-4-methyl-N-[3-(1,3-oxazol-5-yl)phenyl]pentanamide
SMILESCC(C)C[C@H](N)C(=O)Nc1cccc(-c2cnco2)c1
InChIInChI=1S/C15H19N3O2/c1-10(2)6-13(16)15(19)18-12-5-3-4-11(7-12)14-8-17-9-20-14/h3-5,7-10,13H,6,16H2,1-2H3,(H,18,19)/t13-/m0/s1
InChIKeyMSYBJXNJGLQUFB-ZDUSSCGKSA-N
XLogP2.65
TPSA81.15 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500273.34
LogP ≤ 52.65
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Related Compounds

2-amino-N-[3-(1,3-oxazol-5-yl)phenyl]hexanamide
CID 60926904
2-methyl-N-[3-(1,3-oxazol-5-yl)phenyl]propanamide
CID 47265687
3-amino-N-[3-(1,3-oxazol-5-yl)phenyl]butanamide
CID 54862859
2-amino-3,3-dimethyl-N-[3-(1,3-oxazol-5-yl)phenyl]butanamide
CID 76888066
N-(2,6-dimethylheptan-4-yl)-3-(1,3-oxazol-5-yl)aniline
CID 63453530
5-amino-N-[3-(1,3-oxazol-5-yl)phenyl]hexanamide
CID 82851895
(2R)-2-amino-4-methyl-N-[3-(4-methyl-1,2,4-triazol-3-yl)phenyl]pentanamide
CID 104902677
2-amino-4-methyl-N-[4-(1,3-oxazol-5-yl)-3-(trifluoromethoxy)phenyl]pentanamide
CID 121363401
2-(methylamino)-N-[3-(1,3-oxazol-5-yl)phenyl]-3-phenylpropanamide
CID 123157870
3-methyl-5-[3-(1,3-oxazol-5-yl)anilino]-5-oxopentanoic acid
CID 62965913
2-amino-4-methyl-N-[3-(1H-pyrazol-5-yl)phenyl]pentanamide
CID 43711252
2-bromo-N-[3-(1,3-oxazol-5-yl)phenyl]acetamide
CID 63678754

Frequently Asked Questions

What is the IUPAC name of (2S)-2-amino-4-methyl-N-[3-(1,3-oxazol-5-yl)phenyl]pentanamide?
The IUPAC name of (2S)-2-amino-4-methyl-N-[3-(1,3-oxazol-5-yl)phenyl]pentanamide (CID 61180352) is (2S)-2-amino-4-methyl-N-[3-(1,3-oxazol-5-yl)phenyl]pentanamide.
What is the SMILES notation for (2S)-2-amino-4-methyl-N-[3-(1,3-oxazol-5-yl)phenyl]pentanamide?
The canonical SMILES for (2S)-2-amino-4-methyl-N-[3-(1,3-oxazol-5-yl)phenyl]pentanamide is CC(C)C[C@H](N)C(=O)Nc1cccc(-c2cnco2)c1.
What is the InChIKey of (2S)-2-amino-4-methyl-N-[3-(1,3-oxazol-5-yl)phenyl]pentanamide?
The InChIKey is MSYBJXNJGLQUFB-ZDUSSCGKSA-N. The full InChI is InChI=1S/C15H19N3O2/c1-10(2)6-13(16)15(19)18-12-5-3-4-11(7-12)14-8-17-9-20-14/h3-5,7-10,13H,6,16H2,1-2H3,(H,18,19)/t13-/m0/s1.
What are the key properties of (2S)-2-amino-4-methyl-N-[3-(1,3-oxazol-5-yl)phenyl]pentanamide?
(2S)-2-amino-4-methyl-N-[3-(1,3-oxazol-5-yl)phenyl]pentanamide has a molecular weight of 273.34 g/mol, XLogP of 2.65, 5 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for (2S)-2-amino-4-methyl-N-[3-(1,3-oxazol-5-yl)phenyl]pentanamide is sourced from PubChem (CID 61180352), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).