N-[(5-methyl-4-phenyl-1,3-oxazol-2-yl)methyl]pyridine-4-carboxamide

C17H15N3O2 — CID 84509149

IUPACN-[(5-methyl-4-phenyl-1,3-oxazol-2-yl)methyl]pyridine-4-carboxamide
SMILESCc1oc(CNC(=O)c2ccncc2)nc1-c1ccccc1
InChIInChI=1S/C17H15N3O2/c1-12-16(13-5-3-2-4-6-13)20-15(22-12)11-19-17(21)14-7-9-18-10-8-14/h2-10H,11H2,1H3,(H,19,21)
InChIKeyBCGFPPLFYHVJLZ-UHFFFAOYSA-N
MW293.33 g/mol
LogP2.98
Rot. Bonds4

About N-[(5-methyl-4-phenyl-1,3-oxazol-2-yl)methyl]pyridine-4-carboxamide

N-[(5-methyl-4-phenyl-1,3-oxazol-2-yl)methyl]pyridine-4-carboxamide (PubChem CID 84509149) has the molecular formula C17H15N3O2 and a molecular weight of 293.33 g/mol. Its IUPAC name is N-[(5-methyl-4-phenyl-1,3-oxazol-2-yl)methyl]pyridine-4-carboxamide.

Molecular Properties

Compound NameN-[(5-methyl-4-phenyl-1,3-oxazol-2-yl)methyl]pyridine-4-carboxamide
PubChem CID84509149
Molecular FormulaC17H15N3O2
Molecular Weight293.33 g/mol
Exact Mass293.12
IUPAC NameN-[(5-methyl-4-phenyl-1,3-oxazol-2-yl)methyl]pyridine-4-carboxamide
SMILESCc1oc(CNC(=O)c2ccncc2)nc1-c1ccccc1
InChIInChI=1S/C17H15N3O2/c1-12-16(13-5-3-2-4-6-13)20-15(22-12)11-19-17(21)14-7-9-18-10-8-14/h2-10H,11H2,1H3,(H,19,21)
InChIKeyBCGFPPLFYHVJLZ-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

3-(dimethylamino)-N-[(5-methyl-4-phenyl-1,3-oxazol-2-yl)methyl]benzamide
CID 110666314
ethyl N-[(5-methyl-4-phenyl-1,3-oxazol-2-yl)methyl]carbamate
CID 110666364
1-[(5-methyl-4-phenyl-1,3-oxazol-2-yl)methyl]-3-propan-2-ylurea
CID 110666422
N-[(5-methyl-4-phenyl-1,3-oxazol-2-yl)methyl]-3-thiophen-2-ylpropanamide
CID 110666367
N-[(4-methyl-2-phenyl-1,3-thiazol-5-yl)methyl]pyridine-4-carboxamide
CID 67080034
1-acetyl-N-[(5-methyl-4-phenyl-1,3-oxazol-2-yl)methyl]piperidine-4-carboxamide
CID 110666323
2-(4-methylphenoxy)-N-[(5-methyl-4-phenyl-1,3-oxazol-2-yl)methyl]acetamide
CID 110666359
N-[(3-pyridin-4-ylpyrazin-2-yl)methyl]benzamide
CID 126854250
N-[[5-(2-methylphenyl)-1,3,4-oxadiazol-2-yl]methyl]pyridine-4-carboxamide
CID 110319287
2-(3-methylphenoxy)-N-[(5-methyl-4-phenyl-1,3-oxazol-2-yl)methyl]acetamide
CID 110666377
N-[(2-phenylphenyl)methyl]pyridine-4-carboxamide
CID 23497805
N-benzylpyridine-4-carboxamide;hydrochloride
CID 110755427

Frequently Asked Questions

What is the IUPAC name of N-[(5-methyl-4-phenyl-1,3-oxazol-2-yl)methyl]pyridine-4-carboxamide?
The IUPAC name of N-[(5-methyl-4-phenyl-1,3-oxazol-2-yl)methyl]pyridine-4-carboxamide (CID 84509149) is N-[(5-methyl-4-phenyl-1,3-oxazol-2-yl)methyl]pyridine-4-carboxamide.
What is the SMILES notation for N-[(5-methyl-4-phenyl-1,3-oxazol-2-yl)methyl]pyridine-4-carboxamide?
The canonical SMILES for N-[(5-methyl-4-phenyl-1,3-oxazol-2-yl)methyl]pyridine-4-carboxamide is Cc1oc(CNC(=O)c2ccncc2)nc1-c1ccccc1.
What is the InChIKey of N-[(5-methyl-4-phenyl-1,3-oxazol-2-yl)methyl]pyridine-4-carboxamide?
The InChIKey is BCGFPPLFYHVJLZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H15N3O2/c1-12-16(13-5-3-2-4-6-13)20-15(22-12)11-19-17(21)14-7-9-18-10-8-14/h2-10H,11H2,1H3,(H,19,21).
What are the key properties of N-[(5-methyl-4-phenyl-1,3-oxazol-2-yl)methyl]pyridine-4-carboxamide?
N-[(5-methyl-4-phenyl-1,3-oxazol-2-yl)methyl]pyridine-4-carboxamide 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-[(5-methyl-4-phenyl-1,3-oxazol-2-yl)methyl]pyridine-4-carboxamide is sourced from PubChem (CID 84509149), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).