5-(difluoromethyl)-6-(hydroxymethyl)pyridine-3-carboxamide

C8H8F2N2O2 — CID 142742823

IUPAC5-(difluoromethyl)-6-(hydroxymethyl)pyridine-3-carboxamide
SMILESNC(=O)c1cnc(CO)c(C(F)F)c1
InChIInChI=1S/C8H8F2N2O2/c9-7(10)5-1-4(8(11)14)2-12-6(5)3-13/h1-2,7,13H,3H2,(H2,11,14)
InChIKeyAUGQPJLVHAJTGW-UHFFFAOYSA-N
MW202.16 g/mol
LogP0.61
Rot. Bonds3

About 5-(difluoromethyl)-6-(hydroxymethyl)pyridine-3-carboxamide

5-(difluoromethyl)-6-(hydroxymethyl)pyridine-3-carboxamide (PubChem CID 142742823) has the molecular formula C8H8F2N2O2 and a molecular weight of 202.16 g/mol. Its IUPAC name is 5-(difluoromethyl)-6-(hydroxymethyl)pyridine-3-carboxamide.

Molecular Properties

Compound Name5-(difluoromethyl)-6-(hydroxymethyl)pyridine-3-carboxamide
PubChem CID142742823
Molecular FormulaC8H8F2N2O2
Molecular Weight202.16 g/mol
Exact Mass202.06
IUPAC Name5-(difluoromethyl)-6-(hydroxymethyl)pyridine-3-carboxamide
SMILESNC(=O)c1cnc(CO)c(C(F)F)c1
InChIInChI=1S/C8H8F2N2O2/c9-7(10)5-1-4(8(11)14)2-12-6(5)3-13/h1-2,7,13H,3H2,(H2,11,14)
InChIKeyAUGQPJLVHAJTGW-UHFFFAOYSA-N
XLogP0.61
TPSA76.21 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500202.16
LogP ≤ 50.61
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 5-(difluoromethyl)-6-(hydroxymethyl)pyridine-3-carboxamide?
The IUPAC name of 5-(difluoromethyl)-6-(hydroxymethyl)pyridine-3-carboxamide (CID 142742823) is 5-(difluoromethyl)-6-(hydroxymethyl)pyridine-3-carboxamide.
What is the SMILES notation for 5-(difluoromethyl)-6-(hydroxymethyl)pyridine-3-carboxamide?
The canonical SMILES for 5-(difluoromethyl)-6-(hydroxymethyl)pyridine-3-carboxamide is NC(=O)c1cnc(CO)c(C(F)F)c1.
What is the InChIKey of 5-(difluoromethyl)-6-(hydroxymethyl)pyridine-3-carboxamide?
The InChIKey is AUGQPJLVHAJTGW-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H8F2N2O2/c9-7(10)5-1-4(8(11)14)2-12-6(5)3-13/h1-2,7,13H,3H2,(H2,11,14).
What are the key properties of 5-(difluoromethyl)-6-(hydroxymethyl)pyridine-3-carboxamide?
5-(difluoromethyl)-6-(hydroxymethyl)pyridine-3-carboxamide has a molecular weight of 202.16 g/mol, XLogP of 0.61, 3 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 5-(difluoromethyl)-6-(hydroxymethyl)pyridine-3-carboxamide is sourced from PubChem (CID 142742823), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).