N-butyl-2-(5-methyl-2-pyridin-3-yl-1,3-oxazol-4-yl)acetamide

C15H19N3O2 — CID 110371856

IUPACN-butyl-2-(5-methyl-2-pyridin-3-yl-1,3-oxazol-4-yl)acetamide
SMILESCCCCNC(=O)Cc1nc(-c2cccnc2)oc1C
InChIInChI=1S/C15H19N3O2/c1-3-4-8-17-14(19)9-13-11(2)20-15(18-13)12-6-5-7-16-10-12/h5-7,10H,3-4,8-9H2,1-2H3,(H,17,19)
InChIKeyKNBXQNYMBXYENR-UHFFFAOYSA-N
MW273.34 g/mol
LogP2.50
Rot. Bonds6

About N-butyl-2-(5-methyl-2-pyridin-3-yl-1,3-oxazol-4-yl)acetamide

N-butyl-2-(5-methyl-2-pyridin-3-yl-1,3-oxazol-4-yl)acetamide (PubChem CID 110371856) has the molecular formula C15H19N3O2 and a molecular weight of 273.34 g/mol. Its IUPAC name is N-butyl-2-(5-methyl-2-pyridin-3-yl-1,3-oxazol-4-yl)acetamide.

Molecular Properties

Compound NameN-butyl-2-(5-methyl-2-pyridin-3-yl-1,3-oxazol-4-yl)acetamide
PubChem CID110371856
Molecular FormulaC15H19N3O2
Molecular Weight273.34 g/mol
Exact Mass273.15
IUPAC NameN-butyl-2-(5-methyl-2-pyridin-3-yl-1,3-oxazol-4-yl)acetamide
SMILESCCCCNC(=O)Cc1nc(-c2cccnc2)oc1C
InChIInChI=1S/C15H19N3O2/c1-3-4-8-17-14(19)9-13-11(2)20-15(18-13)12-6-5-7-16-10-12/h5-7,10H,3-4,8-9H2,1-2H3,(H,17,19)
InChIKeyKNBXQNYMBXYENR-UHFFFAOYSA-N
XLogP2.50
TPSA68.02 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds6
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500273.34
LogP ≤ 52.50
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Aliphatic_long_chain', 'substructure': 'N/A'}

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Related Compounds

N-[3-(dimethylamino)propyl]-2-(5-methyl-2-pyridin-3-yl-1,3-oxazol-4-yl)acetamide
CID 110371871
2-(5-methyl-2-phenyl-1,3-oxazol-4-yl)-N-pentylacetamide
CID 46529017
N-[(4-fluorophenyl)methyl]-2-(5-methyl-2-pyridin-3-yl-1,3-oxazol-4-yl)acetamide
CID 110371882
N-[(4-methoxyphenyl)methyl]-2-(5-methyl-2-pyridin-3-yl-1,3-oxazol-4-yl)acetamide
CID 110371886
N-(2-bromophenyl)-2-(5-methyl-2-pyridin-3-yl-1,3-oxazol-4-yl)acetamide
CID 110371988
2-(5-methyl-2-pyridin-3-yl-1,3-oxazol-4-yl)-N-(1-phenylethyl)acetamide
CID 110371879
2-(5-methyl-2-pyridin-3-yl-1,3-oxazol-4-yl)-1-pyrrolidin-1-ylethanone
CID 110371859
N-(4-acetamidobutyl)-2-[2-(3-fluorophenyl)-5-methyl-1,3-oxazol-4-yl]acetamide
CID 110417936
N-(3-aminobutyl)-2-(5-methyl-2-phenyl-1,3-oxazol-4-yl)acetamide
CID 119497322
N-(3-acetamidopropyl)-2-[2-(4-tert-butylphenyl)-5-methyl-1,3-oxazol-4-yl]acetamide
CID 110630679
N-[2-[[(2R)-butan-2-yl]-methylamino]ethyl]-2-(5-methyl-2-phenyl-1,3-oxazol-4-yl)acetamide
CID 95167723
N-[2-(methylamino)-2-oxoethyl]-2-(5-methyl-2-phenyl-1,3-oxazol-4-yl)acetamide
CID 32562086

Frequently Asked Questions

What is the IUPAC name of N-butyl-2-(5-methyl-2-pyridin-3-yl-1,3-oxazol-4-yl)acetamide?
The IUPAC name of N-butyl-2-(5-methyl-2-pyridin-3-yl-1,3-oxazol-4-yl)acetamide (CID 110371856) is N-butyl-2-(5-methyl-2-pyridin-3-yl-1,3-oxazol-4-yl)acetamide.
What is the SMILES notation for N-butyl-2-(5-methyl-2-pyridin-3-yl-1,3-oxazol-4-yl)acetamide?
The canonical SMILES for N-butyl-2-(5-methyl-2-pyridin-3-yl-1,3-oxazol-4-yl)acetamide is CCCCNC(=O)Cc1nc(-c2cccnc2)oc1C.
What is the InChIKey of N-butyl-2-(5-methyl-2-pyridin-3-yl-1,3-oxazol-4-yl)acetamide?
The InChIKey is KNBXQNYMBXYENR-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H19N3O2/c1-3-4-8-17-14(19)9-13-11(2)20-15(18-13)12-6-5-7-16-10-12/h5-7,10H,3-4,8-9H2,1-2H3,(H,17,19).
What are the key properties of N-butyl-2-(5-methyl-2-pyridin-3-yl-1,3-oxazol-4-yl)acetamide?
N-butyl-2-(5-methyl-2-pyridin-3-yl-1,3-oxazol-4-yl)acetamide has a molecular weight of 273.34 g/mol, XLogP of 2.50, 6 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-butyl-2-(5-methyl-2-pyridin-3-yl-1,3-oxazol-4-yl)acetamide is sourced from PubChem (CID 110371856), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).