1-(2,5-difluorophenyl)-4-methyl-N-(1,3-oxazol-2-yl)-2-oxopyridine-3-carboxamide

C16H11F2N3O3 — CID 172661883

IUPAC1-(2,5-difluorophenyl)-4-methyl-N-(1,3-oxazol-2-yl)-2-oxopyridine-3-carboxamide
SMILESCc1ccn(-c2cc(F)ccc2F)c(=O)c1C(=O)Nc1ncco1
InChIInChI=1S/C16H11F2N3O3/c1-9-4-6-21(12-8-10(17)2-3-11(12)18)15(23)13(9)14(22)20-16-19-5-7-24-16/h2-8H,1H3,(H,19,20,22)
InChIKeyHEDMAISBICNHOP-UHFFFAOYSA-N
MW331.28 g/mol
LogP2.66
Rot. Bonds3

About 1-(2,5-difluorophenyl)-4-methyl-N-(1,3-oxazol-2-yl)-2-oxopyridine-3-carboxamide

1-(2,5-difluorophenyl)-4-methyl-N-(1,3-oxazol-2-yl)-2-oxopyridine-3-carboxamide (PubChem CID 172661883) has the molecular formula C16H11F2N3O3 and a molecular weight of 331.28 g/mol. Its IUPAC name is 1-(2,5-difluorophenyl)-4-methyl-N-(1,3-oxazol-2-yl)-2-oxopyridine-3-carboxamide.

Molecular Properties

Compound Name1-(2,5-difluorophenyl)-4-methyl-N-(1,3-oxazol-2-yl)-2-oxopyridine-3-carboxamide
PubChem CID172661883
Molecular FormulaC16H11F2N3O3
Molecular Weight331.28 g/mol
Exact Mass331.08
IUPAC Name1-(2,5-difluorophenyl)-4-methyl-N-(1,3-oxazol-2-yl)-2-oxopyridine-3-carboxamide
SMILESCc1ccn(-c2cc(F)ccc2F)c(=O)c1C(=O)Nc1ncco1
InChIInChI=1S/C16H11F2N3O3/c1-9-4-6-21(12-8-10(17)2-3-11(12)18)15(23)13(9)14(22)20-16-19-5-7-24-16/h2-8H,1H3,(H,19,20,22)
InChIKeyHEDMAISBICNHOP-UHFFFAOYSA-N
XLogP2.66
TPSA77.13 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds3
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500331.28
LogP ≤ 52.66
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Related Compounds

N-1,3-Oxazol-2-yl-N'-phenylcarbamimidic acid
CID 118568
Urea, 1-(2-oxazolyl)-3-(o-tolyl)-
CID 118851
Phenylaminooxazole
CID 53721896
Methyl 4-[[4-fluoro-3-(1,3-oxazol-2-ylcarbamoylamino)phenyl]methyl]piperazine-1-carboxylate
CID 11581630
2,6-difluoro-N-[4-[4-methyl-1-(1,3-oxazol-2-yl)-3,6-dihydro-2H-pyridin-5-yl]phenyl]benzamide
CID 24831434
2,2-dichloro-N-[2-(trifluoromethyl)phenyl]acetamide;N-(1,3-oxazol-2-yl)-3-oxopropanamide
CID 88598718
N-(2-fluorophenyl)-1,3-oxazol-2-amine
CID 141013030
N-[(2-fluorophenyl)methyl]-5-methyl-N-(1,3-oxazol-2-yl)-2H-pyrrole-3-carboxamide
CID 147039970
N-[(3Z,5E)-6-[2-(2-fluoroanilino)-1,3-oxazol-5-yl]hepta-1,3,5-trien-2-yl]acetamide
CID 156511242
CID 161698342
CID 161698342
3-N-(1,3-oxazol-2-yl)benzene-1,3-diamine
CID 66720785
[3-(1,3-Oxazol-2-ylamino)phenyl]urea
CID 66720962

Frequently Asked Questions

What is the IUPAC name of 1-(2,5-difluorophenyl)-4-methyl-N-(1,3-oxazol-2-yl)-2-oxopyridine-3-carboxamide?
The IUPAC name of 1-(2,5-difluorophenyl)-4-methyl-N-(1,3-oxazol-2-yl)-2-oxopyridine-3-carboxamide (CID 172661883) is 1-(2,5-difluorophenyl)-4-methyl-N-(1,3-oxazol-2-yl)-2-oxopyridine-3-carboxamide.
What is the SMILES notation for 1-(2,5-difluorophenyl)-4-methyl-N-(1,3-oxazol-2-yl)-2-oxopyridine-3-carboxamide?
The canonical SMILES for 1-(2,5-difluorophenyl)-4-methyl-N-(1,3-oxazol-2-yl)-2-oxopyridine-3-carboxamide is Cc1ccn(-c2cc(F)ccc2F)c(=O)c1C(=O)Nc1ncco1.
What is the InChIKey of 1-(2,5-difluorophenyl)-4-methyl-N-(1,3-oxazol-2-yl)-2-oxopyridine-3-carboxamide?
The InChIKey is HEDMAISBICNHOP-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H11F2N3O3/c1-9-4-6-21(12-8-10(17)2-3-11(12)18)15(23)13(9)14(22)20-16-19-5-7-24-16/h2-8H,1H3,(H,19,20,22).
What are the key properties of 1-(2,5-difluorophenyl)-4-methyl-N-(1,3-oxazol-2-yl)-2-oxopyridine-3-carboxamide?
1-(2,5-difluorophenyl)-4-methyl-N-(1,3-oxazol-2-yl)-2-oxopyridine-3-carboxamide has a molecular weight of 331.28 g/mol, XLogP of 2.66, 3 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(2,5-difluorophenyl)-4-methyl-N-(1,3-oxazol-2-yl)-2-oxopyridine-3-carboxamide is sourced from PubChem (CID 172661883), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).