N-(3,4-difluorophenyl)-5-hydroxypyridine-3-carboxamide

C12H8F2N2O2 — CID 63864937

IUPACN-(3,4-difluorophenyl)-5-hydroxypyridine-3-carboxamide
SMILESO=C(Nc1ccc(F)c(F)c1)c1cncc(O)c1
InChIInChI=1S/C12H8F2N2O2/c13-10-2-1-8(4-11(10)14)16-12(18)7-3-9(17)6-15-5-7/h1-6,17H,(H,16,18)
InChIKeyCZXFMUPKCRKFIX-UHFFFAOYSA-N
MW250.20 g/mol
LogP2.32
Rot. Bonds2

About N-(3,4-difluorophenyl)-5-hydroxypyridine-3-carboxamide

N-(3,4-difluorophenyl)-5-hydroxypyridine-3-carboxamide (PubChem CID 63864937) has the molecular formula C12H8F2N2O2 and a molecular weight of 250.20 g/mol. Its IUPAC name is N-(3,4-difluorophenyl)-5-hydroxypyridine-3-carboxamide.

Molecular Properties

Compound NameN-(3,4-difluorophenyl)-5-hydroxypyridine-3-carboxamide
PubChem CID63864937
Molecular FormulaC12H8F2N2O2
Molecular Weight250.20 g/mol
Exact Mass250.06
IUPAC NameN-(3,4-difluorophenyl)-5-hydroxypyridine-3-carboxamide
SMILESO=C(Nc1ccc(F)c(F)c1)c1cncc(O)c1
InChIInChI=1S/C12H8F2N2O2/c13-10-2-1-8(4-11(10)14)16-12(18)7-3-9(17)6-15-5-7/h1-6,17H,(H,16,18)
InChIKeyCZXFMUPKCRKFIX-UHFFFAOYSA-N
XLogP2.32
TPSA62.22 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms18
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500250.20
LogP ≤ 52.32
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of N-(3,4-difluorophenyl)-5-hydroxypyridine-3-carboxamide?
The IUPAC name of N-(3,4-difluorophenyl)-5-hydroxypyridine-3-carboxamide (CID 63864937) is N-(3,4-difluorophenyl)-5-hydroxypyridine-3-carboxamide.
What is the SMILES notation for N-(3,4-difluorophenyl)-5-hydroxypyridine-3-carboxamide?
The canonical SMILES for N-(3,4-difluorophenyl)-5-hydroxypyridine-3-carboxamide is O=C(Nc1ccc(F)c(F)c1)c1cncc(O)c1.
What is the InChIKey of N-(3,4-difluorophenyl)-5-hydroxypyridine-3-carboxamide?
The InChIKey is CZXFMUPKCRKFIX-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H8F2N2O2/c13-10-2-1-8(4-11(10)14)16-12(18)7-3-9(17)6-15-5-7/h1-6,17H,(H,16,18).
What are the key properties of N-(3,4-difluorophenyl)-5-hydroxypyridine-3-carboxamide?
N-(3,4-difluorophenyl)-5-hydroxypyridine-3-carboxamide has a molecular weight of 250.20 g/mol, XLogP of 2.32, 2 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-(3,4-difluorophenyl)-5-hydroxypyridine-3-carboxamide is sourced from PubChem (CID 63864937), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).