5-fluoro-N-[4-(1-hydroxyethyl)phenyl]pyridine-3-carboxamide

C14H13FN2O2 — CID 104786162

IUPAC5-fluoro-N-[4-(1-hydroxyethyl)phenyl]pyridine-3-carboxamide
SMILESCC(O)c1ccc(NC(=O)c2cncc(F)c2)cc1
InChIInChI=1S/C14H13FN2O2/c1-9(18)10-2-4-13(5-3-10)17-14(19)11-6-12(15)8-16-7-11/h2-9,18H,1H3,(H,17,19)
InChIKeyINLROBQMGPWCEY-UHFFFAOYSA-N
MW260.27 g/mol
LogP2.53
Rot. Bonds3

About 5-fluoro-N-[4-(1-hydroxyethyl)phenyl]pyridine-3-carboxamide

5-fluoro-N-[4-(1-hydroxyethyl)phenyl]pyridine-3-carboxamide (PubChem CID 104786162) has the molecular formula C14H13FN2O2 and a molecular weight of 260.27 g/mol. Its IUPAC name is 5-fluoro-N-[4-(1-hydroxyethyl)phenyl]pyridine-3-carboxamide.

Molecular Properties

Compound Name5-fluoro-N-[4-(1-hydroxyethyl)phenyl]pyridine-3-carboxamide
PubChem CID104786162
Molecular FormulaC14H13FN2O2
Molecular Weight260.27 g/mol
Exact Mass260.10
IUPAC Name5-fluoro-N-[4-(1-hydroxyethyl)phenyl]pyridine-3-carboxamide
SMILESCC(O)c1ccc(NC(=O)c2cncc(F)c2)cc1
InChIInChI=1S/C14H13FN2O2/c1-9(18)10-2-4-13(5-3-10)17-14(19)11-6-12(15)8-16-7-11/h2-9,18H,1H3,(H,17,19)
InChIKeyINLROBQMGPWCEY-UHFFFAOYSA-N
XLogP2.53
TPSA62.22 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500260.27
LogP ≤ 52.53
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

N-[4-[[2-(dimethylamino)acetyl]amino]phenyl]-5-fluoropyridine-3-carboxamide
CID 131920050
3-N-phenyl-5-N-(4-propan-2-ylphenyl)pyridine-3,5-dicarboxamide
CID 109107769
5-fluoro-N-[4-[(E)-N'-hydroxycarbamimidoyl]phenyl]pyridine-3-carboxamide
CID 104786337
N-[4-(2-aminoethyl)phenyl]-5-fluoropyridine-3-carboxamide
CID 104785334
N-[4-(2-bromoethyl)phenyl]-5-fluoropyridine-3-carboxamide
CID 104786611
2,4,6-trifluoro-N-[4-(1-hydroxyethyl)phenyl]benzamide
CID 65100671
N-(4-bromo-3-fluorophenyl)-5-fluoropyridine-3-carboxamide
CID 115694774
N-(4-amino-3-fluorophenyl)-5-fluoropyridine-3-carboxamide
CID 104785444
3,5-difluoro-N-(4-propan-2-ylphenyl)benzamide
CID 4785745
5-fluoro-N-(3-hydroxyphenyl)pyridine-3-carboxamide
CID 113287958
N-(5-fluoro-3-pyridinyl)-4-(methylamino)benzamide
CID 114253893
5-bromo-N-(4-butan-2-ylphenyl)pyridine-3-carboxamide
CID 60628517

Frequently Asked Questions

What is the IUPAC name of 5-fluoro-N-[4-(1-hydroxyethyl)phenyl]pyridine-3-carboxamide?
The IUPAC name of 5-fluoro-N-[4-(1-hydroxyethyl)phenyl]pyridine-3-carboxamide (CID 104786162) is 5-fluoro-N-[4-(1-hydroxyethyl)phenyl]pyridine-3-carboxamide.
What is the SMILES notation for 5-fluoro-N-[4-(1-hydroxyethyl)phenyl]pyridine-3-carboxamide?
The canonical SMILES for 5-fluoro-N-[4-(1-hydroxyethyl)phenyl]pyridine-3-carboxamide is CC(O)c1ccc(NC(=O)c2cncc(F)c2)cc1.
What is the InChIKey of 5-fluoro-N-[4-(1-hydroxyethyl)phenyl]pyridine-3-carboxamide?
The InChIKey is INLROBQMGPWCEY-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H13FN2O2/c1-9(18)10-2-4-13(5-3-10)17-14(19)11-6-12(15)8-16-7-11/h2-9,18H,1H3,(H,17,19).
What are the key properties of 5-fluoro-N-[4-(1-hydroxyethyl)phenyl]pyridine-3-carboxamide?
5-fluoro-N-[4-(1-hydroxyethyl)phenyl]pyridine-3-carboxamide has a molecular weight of 260.27 g/mol, XLogP of 2.53, 3 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 5-fluoro-N-[4-(1-hydroxyethyl)phenyl]pyridine-3-carboxamide is sourced from PubChem (CID 104786162), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).