2,6-difluoro-N-[5-[3-(furan-2-yl)-1-methylpyrazol-5-yl]-2-pyridinyl]benzamide

C20H14F2N4O2 — CID 58487193

IUPAC2,6-difluoro-N-[5-[3-(furan-2-yl)-1-methylpyrazol-5-yl]-2-pyridinyl]benzamide
SMILESCn1nc(-c2ccco2)cc1-c1ccc(NC(=O)c2c(F)cccc2F)nc1
InChIInChI=1S/C20H14F2N4O2/c1-26-16(10-15(25-26)17-6-3-9-28-17)12-7-8-18(23-11-12)24-20(27)19-13(21)4-2-5-14(19)22/h2-11H,1H3,(H,23,24,27)
InChIKeyYGNMCFCPNRWVIY-UHFFFAOYSA-N
MW380.35 g/mol
LogP4.27
Rot. Bonds4

About 2,6-difluoro-N-[5-[3-(furan-2-yl)-1-methylpyrazol-5-yl]-2-pyridinyl]benzamide

2,6-difluoro-N-[5-[3-(furan-2-yl)-1-methylpyrazol-5-yl]-2-pyridinyl]benzamide (PubChem CID 58487193) has the molecular formula C20H14F2N4O2 and a molecular weight of 380.35 g/mol. Its IUPAC name is 2,6-difluoro-N-[5-[3-(furan-2-yl)-1-methylpyrazol-5-yl]-2-pyridinyl]benzamide.

Molecular Properties

Compound Name2,6-difluoro-N-[5-[3-(furan-2-yl)-1-methylpyrazol-5-yl]-2-pyridinyl]benzamide
PubChem CID58487193
Molecular FormulaC20H14F2N4O2
Molecular Weight380.35 g/mol
Exact Mass380.11
IUPAC Name2,6-difluoro-N-[5-[3-(furan-2-yl)-1-methylpyrazol-5-yl]-2-pyridinyl]benzamide
SMILESCn1nc(-c2ccco2)cc1-c1ccc(NC(=O)c2c(F)cccc2F)nc1
InChIInChI=1S/C20H14F2N4O2/c1-26-16(10-15(25-26)17-6-3-9-28-17)12-7-8-18(23-11-12)24-20(27)19-13(21)4-2-5-14(19)22/h2-11H,1H3,(H,23,24,27)
InChIKeyYGNMCFCPNRWVIY-UHFFFAOYSA-N
XLogP4.27
TPSA72.95 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds4
Heavy Atoms28
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500380.35
LogP ≤ 54.27
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Frequently Asked Questions

What is the IUPAC name of 2,6-difluoro-N-[5-[3-(furan-2-yl)-1-methylpyrazol-5-yl]-2-pyridinyl]benzamide?
The IUPAC name of 2,6-difluoro-N-[5-[3-(furan-2-yl)-1-methylpyrazol-5-yl]-2-pyridinyl]benzamide (CID 58487193) is 2,6-difluoro-N-[5-[3-(furan-2-yl)-1-methylpyrazol-5-yl]-2-pyridinyl]benzamide.
What is the SMILES notation for 2,6-difluoro-N-[5-[3-(furan-2-yl)-1-methylpyrazol-5-yl]-2-pyridinyl]benzamide?
The canonical SMILES for 2,6-difluoro-N-[5-[3-(furan-2-yl)-1-methylpyrazol-5-yl]-2-pyridinyl]benzamide is Cn1nc(-c2ccco2)cc1-c1ccc(NC(=O)c2c(F)cccc2F)nc1.
What is the InChIKey of 2,6-difluoro-N-[5-[3-(furan-2-yl)-1-methylpyrazol-5-yl]-2-pyridinyl]benzamide?
The InChIKey is YGNMCFCPNRWVIY-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H14F2N4O2/c1-26-16(10-15(25-26)17-6-3-9-28-17)12-7-8-18(23-11-12)24-20(27)19-13(21)4-2-5-14(19)22/h2-11H,1H3,(H,23,24,27).
What are the key properties of 2,6-difluoro-N-[5-[3-(furan-2-yl)-1-methylpyrazol-5-yl]-2-pyridinyl]benzamide?
2,6-difluoro-N-[5-[3-(furan-2-yl)-1-methylpyrazol-5-yl]-2-pyridinyl]benzamide has a molecular weight of 380.35 g/mol, XLogP of 4.27, 4 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 2,6-difluoro-N-[5-[3-(furan-2-yl)-1-methylpyrazol-5-yl]-2-pyridinyl]benzamide is sourced from PubChem (CID 58487193), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).