2-fluoro-N-(2-hydroxy-2-methylpropyl)pyridine-4-carboxamide

C10H13FN2O2 — CID 65106911

IUPAC2-fluoro-N-(2-hydroxy-2-methylpropyl)pyridine-4-carboxamide
SMILESCC(C)(O)CNC(=O)c1ccnc(F)c1
InChIInChI=1S/C10H13FN2O2/c1-10(2,15)6-13-9(14)7-3-4-12-8(11)5-7/h3-5,15H,6H2,1-2H3,(H,13,14)
InChIKeyMOLJWGHACDOULK-UHFFFAOYSA-N
MW212.22 g/mol
LogP0.72
Rot. Bonds3

About 2-fluoro-N-(2-hydroxy-2-methylpropyl)pyridine-4-carboxamide

2-fluoro-N-(2-hydroxy-2-methylpropyl)pyridine-4-carboxamide (PubChem CID 65106911) has the molecular formula C10H13FN2O2 and a molecular weight of 212.22 g/mol. Its IUPAC name is 2-fluoro-N-(2-hydroxy-2-methylpropyl)pyridine-4-carboxamide.

Molecular Properties

Compound Name2-fluoro-N-(2-hydroxy-2-methylpropyl)pyridine-4-carboxamide
PubChem CID65106911
Molecular FormulaC10H13FN2O2
Molecular Weight212.22 g/mol
Exact Mass212.10
IUPAC Name2-fluoro-N-(2-hydroxy-2-methylpropyl)pyridine-4-carboxamide
SMILESCC(C)(O)CNC(=O)c1ccnc(F)c1
InChIInChI=1S/C10H13FN2O2/c1-10(2,15)6-13-9(14)7-3-4-12-8(11)5-7/h3-5,15H,6H2,1-2H3,(H,13,14)
InChIKeyMOLJWGHACDOULK-UHFFFAOYSA-N
XLogP0.72
TPSA62.22 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500212.22
LogP ≤ 50.72
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

Structural Alerts{'alert_name': '2-halo_pyridine', 'substructure': 'N/A'}

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Related Compounds

N-[3-(dimethylamino)-2-hydroxy-2-methylpropyl]-2-fluoropyridine-4-carboxamide
CID 103840043
N-(2-ethyl-2-hydroxypentyl)-2-fluoropyridine-4-carboxamide
CID 144683885
N-[3-(dimethylamino)-2,2-dimethylpropyl]-2-fluoropyridine-4-carboxamide
CID 61293798
2-fluoro-N-[2-(methanesulfonamido)-2-methylpropyl]pyridine-4-carboxamide
CID 63862460
2-fluoro-N-(2-hydroxy-2-thiophen-3-ylpropyl)pyridine-4-carboxamide
CID 111451765
methyl 2-[(2-fluoropyridine-4-carbonyl)amino]acetate
CID 61292675
2-fluoro-N-[2-methyl-2-(4-methylpiperazin-1-yl)propyl]pyridine-4-carboxamide
CID 61294593
N-[2-(2,5-dimethylfuran-3-yl)-2-hydroxypropyl]-2-fluoropyridine-4-carboxamide
CID 111479066
N-(2-hydroxy-2-methylpropyl)pyridine-4-carboxamide
CID 65109884
2-fluoro-N-(3-hydroxy-2-methylpropyl)pyridine-4-carboxamide
CID 65036628
2-fluoro-N-(2-hydroxy-4,4-dimethylpentyl)pyridine-4-carboxamide
CID 113237946
2-fluoro-N-[2-(methylamino)-2-oxoethyl]pyridine-4-carboxamide
CID 61293980

Frequently Asked Questions

What is the IUPAC name of 2-fluoro-N-(2-hydroxy-2-methylpropyl)pyridine-4-carboxamide?
The IUPAC name of 2-fluoro-N-(2-hydroxy-2-methylpropyl)pyridine-4-carboxamide (CID 65106911) is 2-fluoro-N-(2-hydroxy-2-methylpropyl)pyridine-4-carboxamide.
What is the SMILES notation for 2-fluoro-N-(2-hydroxy-2-methylpropyl)pyridine-4-carboxamide?
The canonical SMILES for 2-fluoro-N-(2-hydroxy-2-methylpropyl)pyridine-4-carboxamide is CC(C)(O)CNC(=O)c1ccnc(F)c1.
What is the InChIKey of 2-fluoro-N-(2-hydroxy-2-methylpropyl)pyridine-4-carboxamide?
The InChIKey is MOLJWGHACDOULK-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H13FN2O2/c1-10(2,15)6-13-9(14)7-3-4-12-8(11)5-7/h3-5,15H,6H2,1-2H3,(H,13,14).
What are the key properties of 2-fluoro-N-(2-hydroxy-2-methylpropyl)pyridine-4-carboxamide?
2-fluoro-N-(2-hydroxy-2-methylpropyl)pyridine-4-carboxamide has a molecular weight of 212.22 g/mol, XLogP of 0.72, 3 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-fluoro-N-(2-hydroxy-2-methylpropyl)pyridine-4-carboxamide is sourced from PubChem (CID 65106911), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).