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

C15H19N3O2 — CID 80543333

IUPAC4-amino-2-methyl-N-[4-(2-methyl-1,3-oxazol-4-yl)phenyl]butanamide
SMILESCc1nc(-c2ccc(NC(=O)C(C)CCN)cc2)co1
InChIInChI=1S/C15H19N3O2/c1-10(7-8-16)15(19)18-13-5-3-12(4-6-13)14-9-20-11(2)17-14/h3-6,9-10H,7-8,16H2,1-2H3,(H,18,19)
InChIKeyRLBJFZBSXILQMT-UHFFFAOYSA-N
MW273.34 g/mol
LogP2.57
Rot. Bonds5

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

4-amino-2-methyl-N-[4-(2-methyl-1,3-oxazol-4-yl)phenyl]butanamide (PubChem CID 80543333) has the molecular formula C15H19N3O2 and a molecular weight of 273.34 g/mol. Its IUPAC name is 4-amino-2-methyl-N-[4-(2-methyl-1,3-oxazol-4-yl)phenyl]butanamide.

Molecular Properties

Compound Name4-amino-2-methyl-N-[4-(2-methyl-1,3-oxazol-4-yl)phenyl]butanamide
PubChem CID80543333
Molecular FormulaC15H19N3O2
Molecular Weight273.34 g/mol
Exact Mass273.15
IUPAC Name4-amino-2-methyl-N-[4-(2-methyl-1,3-oxazol-4-yl)phenyl]butanamide
SMILESCc1nc(-c2ccc(NC(=O)C(C)CCN)cc2)co1
InChIInChI=1S/C15H19N3O2/c1-10(7-8-16)15(19)18-13-5-3-12(4-6-13)14-9-20-11(2)17-14/h3-6,9-10H,7-8,16H2,1-2H3,(H,18,19)
InChIKeyRLBJFZBSXILQMT-UHFFFAOYSA-N
XLogP2.57
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 ≤ 52.57
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Related Compounds

5-amino-2-methyl-N-[4-(2-methyl-1,3-oxazol-4-yl)phenyl]pentanamide
CID 104683963
3-amino-N-[4-(2-methyl-1,3-oxazol-4-yl)phenyl]butanamide
CID 60837809
N-(4-acetamidophenyl)-4-amino-2-methylbutanamide
CID 80542104
4-[4-(2-methyl-1,3-oxazol-4-yl)anilino]-4-oxobutanoic acid
CID 60942171
2-bromo-2-methyl-N-[4-(2-methyl-1,3-oxazol-4-yl)phenyl]propanamide
CID 114327857
N-(4-acetylphenyl)-4-amino-2-methylbutanamide
CID 80543884
5-hydroxy-N-[4-(2-methyl-1,3-oxazol-4-yl)phenyl]pentanamide
CID 79199388
4-amino-2-methyl-N-[4-(trifluoromethyl)phenyl]butanamide
CID 80542056
5-amino-2-methyl-N-(4-phenylphenyl)pentanamide
CID 104683998
4-amino-2-methyl-N-[4-(5-oxo-1,2-dihydropyrazol-3-yl)phenyl]butanamide
CID 80543463
4-amino-N-(3,4-difluorophenyl)-2-methylbutanamide
CID 80542126
1-[4-(2-methyl-1,3-oxazol-4-yl)phenyl]-3-[(2R)-2-methyl-3-pyrazol-1-ylpropyl]urea
CID 95761803

Frequently Asked Questions

What is the IUPAC name of 4-amino-2-methyl-N-[4-(2-methyl-1,3-oxazol-4-yl)phenyl]butanamide?
The IUPAC name of 4-amino-2-methyl-N-[4-(2-methyl-1,3-oxazol-4-yl)phenyl]butanamide (CID 80543333) is 4-amino-2-methyl-N-[4-(2-methyl-1,3-oxazol-4-yl)phenyl]butanamide.
What is the SMILES notation for 4-amino-2-methyl-N-[4-(2-methyl-1,3-oxazol-4-yl)phenyl]butanamide?
The canonical SMILES for 4-amino-2-methyl-N-[4-(2-methyl-1,3-oxazol-4-yl)phenyl]butanamide is Cc1nc(-c2ccc(NC(=O)C(C)CCN)cc2)co1.
What is the InChIKey of 4-amino-2-methyl-N-[4-(2-methyl-1,3-oxazol-4-yl)phenyl]butanamide?
The InChIKey is RLBJFZBSXILQMT-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H19N3O2/c1-10(7-8-16)15(19)18-13-5-3-12(4-6-13)14-9-20-11(2)17-14/h3-6,9-10H,7-8,16H2,1-2H3,(H,18,19).
What are the key properties of 4-amino-2-methyl-N-[4-(2-methyl-1,3-oxazol-4-yl)phenyl]butanamide?
4-amino-2-methyl-N-[4-(2-methyl-1,3-oxazol-4-yl)phenyl]butanamide has a molecular weight of 273.34 g/mol, XLogP of 2.57, 5 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 4-amino-2-methyl-N-[4-(2-methyl-1,3-oxazol-4-yl)phenyl]butanamide is sourced from PubChem (CID 80543333), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).