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

C20H13F2N5O2 — CID 11574710

IUPAC3,5-difluoro-N-[5-[2-methyl-5-(1,3-oxazol-5-yl)phenyl]pyrazin-2-yl]pyridine-4-carboxamide
SMILESCc1ccc(-c2cnco2)cc1-c1cnc(NC(=O)c2c(F)cncc2F)cn1
InChIInChI=1S/C20H13F2N5O2/c1-11-2-3-12(17-8-24-10-29-17)4-13(11)16-7-26-18(9-25-16)27-20(28)19-14(21)5-23-6-15(19)22/h2-10H,1H3,(H,26,27,28)
InChIKeyLUGOMEQOCGHHDW-UHFFFAOYSA-N
MW393.35 g/mol
LogP4.03
Rot. Bonds4

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

3,5-difluoro-N-[5-[2-methyl-5-(1,3-oxazol-5-yl)phenyl]pyrazin-2-yl]pyridine-4-carboxamide (PubChem CID 11574710) has the molecular formula C20H13F2N5O2 and a molecular weight of 393.35 g/mol. Its IUPAC name is 3,5-difluoro-N-[5-[2-methyl-5-(1,3-oxazol-5-yl)phenyl]pyrazin-2-yl]pyridine-4-carboxamide.

Molecular Properties

Compound Name3,5-difluoro-N-[5-[2-methyl-5-(1,3-oxazol-5-yl)phenyl]pyrazin-2-yl]pyridine-4-carboxamide
PubChem CID11574710
Molecular FormulaC20H13F2N5O2
Molecular Weight393.35 g/mol
Exact Mass393.10
IUPAC Name3,5-difluoro-N-[5-[2-methyl-5-(1,3-oxazol-5-yl)phenyl]pyrazin-2-yl]pyridine-4-carboxamide
SMILESCc1ccc(-c2cnco2)cc1-c1cnc(NC(=O)c2c(F)cncc2F)cn1
InChIInChI=1S/C20H13F2N5O2/c1-11-2-3-12(17-8-24-10-29-17)4-13(11)16-7-26-18(9-25-16)27-20(28)19-14(21)5-23-6-15(19)22/h2-10H,1H3,(H,26,27,28)
InChIKeyLUGOMEQOCGHHDW-UHFFFAOYSA-N
XLogP4.03
TPSA93.80 Ų
H-Bond Donors1
H-Bond Acceptors6
Rotatable Bonds4
Heavy Atoms29
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500393.35
LogP ≤ 54.03
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 106

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Frequently Asked Questions

What is the IUPAC name of 3,5-difluoro-N-[5-[2-methyl-5-(1,3-oxazol-5-yl)phenyl]pyrazin-2-yl]pyridine-4-carboxamide?
The IUPAC name of 3,5-difluoro-N-[5-[2-methyl-5-(1,3-oxazol-5-yl)phenyl]pyrazin-2-yl]pyridine-4-carboxamide (CID 11574710) is 3,5-difluoro-N-[5-[2-methyl-5-(1,3-oxazol-5-yl)phenyl]pyrazin-2-yl]pyridine-4-carboxamide.
What is the SMILES notation for 3,5-difluoro-N-[5-[2-methyl-5-(1,3-oxazol-5-yl)phenyl]pyrazin-2-yl]pyridine-4-carboxamide?
The canonical SMILES for 3,5-difluoro-N-[5-[2-methyl-5-(1,3-oxazol-5-yl)phenyl]pyrazin-2-yl]pyridine-4-carboxamide is Cc1ccc(-c2cnco2)cc1-c1cnc(NC(=O)c2c(F)cncc2F)cn1.
What is the InChIKey of 3,5-difluoro-N-[5-[2-methyl-5-(1,3-oxazol-5-yl)phenyl]pyrazin-2-yl]pyridine-4-carboxamide?
The InChIKey is LUGOMEQOCGHHDW-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H13F2N5O2/c1-11-2-3-12(17-8-24-10-29-17)4-13(11)16-7-26-18(9-25-16)27-20(28)19-14(21)5-23-6-15(19)22/h2-10H,1H3,(H,26,27,28).
What are the key properties of 3,5-difluoro-N-[5-[2-methyl-5-(1,3-oxazol-5-yl)phenyl]pyrazin-2-yl]pyridine-4-carboxamide?
3,5-difluoro-N-[5-[2-methyl-5-(1,3-oxazol-5-yl)phenyl]pyrazin-2-yl]pyridine-4-carboxamide has a molecular weight of 393.35 g/mol, XLogP of 4.03, 4 rotatable bonds, 1 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 3,5-difluoro-N-[5-[2-methyl-5-(1,3-oxazol-5-yl)phenyl]pyrazin-2-yl]pyridine-4-carboxamide is sourced from PubChem (CID 11574710), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).