N-[(3-methyl-1,2-oxazol-4-yl)methyl]-2-pyridin-4-ylbenzamide

C17H15N3O2 — CID 146099356

IUPACN-[(3-methyl-1,2-oxazol-4-yl)methyl]-2-pyridin-4-ylbenzamide
SMILESCc1nocc1CNC(=O)c1ccccc1-c1ccncc1
InChIInChI=1S/C17H15N3O2/c1-12-14(11-22-20-12)10-19-17(21)16-5-3-2-4-15(16)13-6-8-18-9-7-13/h2-9,11H,10H2,1H3,(H,19,21)
InChIKeyJUBZHZRHHOOKAP-UHFFFAOYSA-N
MW293.33 g/mol
LogP2.98
Rot. Bonds4

About N-[(3-methyl-1,2-oxazol-4-yl)methyl]-2-pyridin-4-ylbenzamide

N-[(3-methyl-1,2-oxazol-4-yl)methyl]-2-pyridin-4-ylbenzamide (PubChem CID 146099356) has the molecular formula C17H15N3O2 and a molecular weight of 293.33 g/mol. Its IUPAC name is N-[(3-methyl-1,2-oxazol-4-yl)methyl]-2-pyridin-4-ylbenzamide.

Molecular Properties

Compound NameN-[(3-methyl-1,2-oxazol-4-yl)methyl]-2-pyridin-4-ylbenzamide
PubChem CID146099356
Molecular FormulaC17H15N3O2
Molecular Weight293.33 g/mol
Exact Mass293.12
IUPAC NameN-[(3-methyl-1,2-oxazol-4-yl)methyl]-2-pyridin-4-ylbenzamide
SMILESCc1nocc1CNC(=O)c1ccccc1-c1ccncc1
InChIInChI=1S/C17H15N3O2/c1-12-14(11-22-20-12)10-19-17(21)16-5-3-2-4-15(16)13-6-8-18-9-7-13/h2-9,11H,10H2,1H3,(H,19,21)
InChIKeyJUBZHZRHHOOKAP-UHFFFAOYSA-N
XLogP2.98
TPSA68.02 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500293.33
LogP ≤ 52.98
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

1-benzyl-3-[(3-methyl-1,2-oxazol-4-yl)methyl]urea
CID 131227713
N-[(2-phenylphenyl)methyl]pyridine-4-carboxamide
CID 23497805
N-[(2-methylphenyl)methyl]-6-oxo-3-pyridin-4-yl-1H-pyridazine-5-carboxamide
CID 59017950
N-(pyridin-3-ylmethyl)-2-[2-(pyridin-3-ylmethylcarbamoyl)phenyl]benzamide
CID 1279662
N-[(3-methyl-1,2-oxazol-4-yl)methyl]cyclopropanecarboxamide
CID 130987515
N-(1-hydroxy-4-methylpentan-3-yl)-2-pyridin-4-ylbenzamide
CID 126834520
4-[2-[1,2,2-tris(2-pyridin-4-ylphenyl)ethenyl]phenyl]pyridine
CID 123619493
N-[[2-(hydroxymethyl)phenyl]methyl]-2-methyl-3-pyridin-2-ylbenzamide
CID 109399422
N-[1-(3,5-dimethylphenyl)ethyl]-2-pyridin-4-ylbenzamide
CID 154851586
2-bromo-N-[(3-methyl-4-pyridinyl)methyl]benzamide
CID 114700594
2-methoxy-N-[(2-methylphenyl)methyl]pyridine-3-carboxamide
CID 110850721
N-pyridin-4-yl-2-[2-(pyridin-4-ylcarbamoyl)phenyl]benzamide
CID 23793145

Frequently Asked Questions

What is the IUPAC name of N-[(3-methyl-1,2-oxazol-4-yl)methyl]-2-pyridin-4-ylbenzamide?
The IUPAC name of N-[(3-methyl-1,2-oxazol-4-yl)methyl]-2-pyridin-4-ylbenzamide (CID 146099356) is N-[(3-methyl-1,2-oxazol-4-yl)methyl]-2-pyridin-4-ylbenzamide.
What is the SMILES notation for N-[(3-methyl-1,2-oxazol-4-yl)methyl]-2-pyridin-4-ylbenzamide?
The canonical SMILES for N-[(3-methyl-1,2-oxazol-4-yl)methyl]-2-pyridin-4-ylbenzamide is Cc1nocc1CNC(=O)c1ccccc1-c1ccncc1.
What is the InChIKey of N-[(3-methyl-1,2-oxazol-4-yl)methyl]-2-pyridin-4-ylbenzamide?
The InChIKey is JUBZHZRHHOOKAP-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H15N3O2/c1-12-14(11-22-20-12)10-19-17(21)16-5-3-2-4-15(16)13-6-8-18-9-7-13/h2-9,11H,10H2,1H3,(H,19,21).
What are the key properties of N-[(3-methyl-1,2-oxazol-4-yl)methyl]-2-pyridin-4-ylbenzamide?
N-[(3-methyl-1,2-oxazol-4-yl)methyl]-2-pyridin-4-ylbenzamide has a molecular weight of 293.33 g/mol, XLogP of 2.98, 4 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-[(3-methyl-1,2-oxazol-4-yl)methyl]-2-pyridin-4-ylbenzamide is sourced from PubChem (CID 146099356), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).