N-(3-amino-2-hydroxy-3-oxopropyl)-6-fluoropyridine-2-carboxamide

C9H10FN3O3 — CID 106166087

IUPACN-(3-amino-2-hydroxy-3-oxopropyl)-6-fluoropyridine-2-carboxamide
SMILESNC(=O)C(O)CNC(=O)c1cccc(F)n1
InChIInChI=1S/C9H10FN3O3/c10-7-3-1-2-5(13-7)9(16)12-4-6(14)8(11)15/h1-3,6,14H,4H2,(H2,11,15)(H,12,16)
InChIKeyCJYAZYRRDFDVQI-UHFFFAOYSA-N
MW227.20 g/mol
LogP-1.20
Rot. Bonds4

About N-(3-amino-2-hydroxy-3-oxopropyl)-6-fluoropyridine-2-carboxamide

N-(3-amino-2-hydroxy-3-oxopropyl)-6-fluoropyridine-2-carboxamide (PubChem CID 106166087) has the molecular formula C9H10FN3O3 and a molecular weight of 227.20 g/mol. Its IUPAC name is N-(3-amino-2-hydroxy-3-oxopropyl)-6-fluoropyridine-2-carboxamide.

Molecular Properties

Compound NameN-(3-amino-2-hydroxy-3-oxopropyl)-6-fluoropyridine-2-carboxamide
PubChem CID106166087
Molecular FormulaC9H10FN3O3
Molecular Weight227.20 g/mol
Exact Mass227.07
IUPAC NameN-(3-amino-2-hydroxy-3-oxopropyl)-6-fluoropyridine-2-carboxamide
SMILESNC(=O)C(O)CNC(=O)c1cccc(F)n1
InChIInChI=1S/C9H10FN3O3/c10-7-3-1-2-5(13-7)9(16)12-4-6(14)8(11)15/h1-3,6,14H,4H2,(H2,11,15)(H,12,16)
InChIKeyCJYAZYRRDFDVQI-UHFFFAOYSA-N
XLogP-1.20
TPSA105.31 Ų
H-Bond Donors3
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500227.20
LogP ≤ 5-1.20
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

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

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Related Compounds

6-fluoro-N-(3-methyl-2-propan-2-ylbutyl)pyridine-2-carboxamide
CID 102904926
6-fluoro-N-(2-methylsulfinylpropyl)pyridine-2-carboxamide
CID 115869324
2-[(6-fluoropyridine-2-carbonyl)amino]acetic acid
CID 115496286
N-(4-amino-4-oxobutan-2-yl)-6-fluoropyridine-2-carboxamide
CID 115869084
6-fluoro-N-[(1-hydroxycyclobutyl)methyl]pyridine-2-carboxamide
CID 109389046
2-[(6-fluoropyridine-2-carbonyl)amino]-4-hydroxybutanoic acid
CID 115496379
6-fluoro-N-(2,2,3-trimethylbutyl)pyridine-2-carboxamide
CID 102612083
6-fluoro-N-[[2-(hydroxymethyl)cyclopentyl]methyl]pyridine-2-carboxamide
CID 115497967
N-(3-amino-2-hydroxy-3-oxopropyl)-2,6-dimethylbenzamide
CID 114152583
6-fluoro-N-[2-(1,3-thiazol-2-yl)propyl]pyridine-2-carboxamide
CID 104579250
6-fluoro-N-[(2-fluorophenyl)methyl]pyridine-2-carboxamide
CID 115496596
6-fluoro-N-pentylpyridine-2-carboxamide
CID 115496637

Frequently Asked Questions

What is the IUPAC name of N-(3-amino-2-hydroxy-3-oxopropyl)-6-fluoropyridine-2-carboxamide?
The IUPAC name of N-(3-amino-2-hydroxy-3-oxopropyl)-6-fluoropyridine-2-carboxamide (CID 106166087) is N-(3-amino-2-hydroxy-3-oxopropyl)-6-fluoropyridine-2-carboxamide.
What is the SMILES notation for N-(3-amino-2-hydroxy-3-oxopropyl)-6-fluoropyridine-2-carboxamide?
The canonical SMILES for N-(3-amino-2-hydroxy-3-oxopropyl)-6-fluoropyridine-2-carboxamide is NC(=O)C(O)CNC(=O)c1cccc(F)n1.
What is the InChIKey of N-(3-amino-2-hydroxy-3-oxopropyl)-6-fluoropyridine-2-carboxamide?
The InChIKey is CJYAZYRRDFDVQI-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H10FN3O3/c10-7-3-1-2-5(13-7)9(16)12-4-6(14)8(11)15/h1-3,6,14H,4H2,(H2,11,15)(H,12,16).
What are the key properties of N-(3-amino-2-hydroxy-3-oxopropyl)-6-fluoropyridine-2-carboxamide?
N-(3-amino-2-hydroxy-3-oxopropyl)-6-fluoropyridine-2-carboxamide has a molecular weight of 227.20 g/mol, XLogP of -1.20, 4 rotatable bonds, 3 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-(3-amino-2-hydroxy-3-oxopropyl)-6-fluoropyridine-2-carboxamide is sourced from PubChem (CID 106166087), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).