N-(3-fluorophenyl)-6-(pyrrolidine-1-carbonyl)pyridine-2-carboxamide

C17H16FN3O2 — CID 109094901

IUPACN-(3-fluorophenyl)-6-(pyrrolidine-1-carbonyl)pyridine-2-carboxamide
SMILESO=C(Nc1cccc(F)c1)c1cccc(C(=O)N2CCCC2)n1
InChIInChI=1S/C17H16FN3O2/c18-12-5-3-6-13(11-12)19-16(22)14-7-4-8-15(20-14)17(23)21-9-1-2-10-21/h3-8,11H,1-2,9-10H2,(H,19,22)
InChIKeyUSTGUOIJZKUEIG-UHFFFAOYSA-N
MW313.33 g/mol
LogP2.71
Rot. Bonds3

About N-(3-fluorophenyl)-6-(pyrrolidine-1-carbonyl)pyridine-2-carboxamide

N-(3-fluorophenyl)-6-(pyrrolidine-1-carbonyl)pyridine-2-carboxamide (PubChem CID 109094901) has the molecular formula C17H16FN3O2 and a molecular weight of 313.33 g/mol. Its IUPAC name is N-(3-fluorophenyl)-6-(pyrrolidine-1-carbonyl)pyridine-2-carboxamide.

Molecular Properties

Compound NameN-(3-fluorophenyl)-6-(pyrrolidine-1-carbonyl)pyridine-2-carboxamide
PubChem CID109094901
Molecular FormulaC17H16FN3O2
Molecular Weight313.33 g/mol
Exact Mass313.12
IUPAC NameN-(3-fluorophenyl)-6-(pyrrolidine-1-carbonyl)pyridine-2-carboxamide
SMILESO=C(Nc1cccc(F)c1)c1cccc(C(=O)N2CCCC2)n1
InChIInChI=1S/C17H16FN3O2/c18-12-5-3-6-13(11-12)19-16(22)14-7-4-8-15(20-14)17(23)21-9-1-2-10-21/h3-8,11H,1-2,9-10H2,(H,19,22)
InChIKeyUSTGUOIJZKUEIG-UHFFFAOYSA-N
XLogP2.71
TPSA62.30 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500313.33
LogP ≤ 52.71
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

6-(azepane-1-carbonyl)-N-(3-chloro-4-methylphenyl)pyridine-2-carboxamide
CID 109099901
N-(3-fluorophenyl)-3-(pyrrolidine-1-carbonyl)benzamide
CID 109051768
N-(4-acetamidophenyl)-6-(piperidine-1-carbonyl)pyridine-2-carboxamide
CID 109095228
3-(azepane-1-carbonyl)-N-(3-fluorophenyl)benzamide
CID 109056732
N-(3-fluorophenyl)-1-(piperidine-1-carbonyl)-5,6,7,8-tetrahydroimidazo[1,5-a]pyridine-3-carboxamide
CID 109074591
N-(3-fluorophenyl)pyrrolidine-1-carboxamide
CID 6469622
methyl 6-[(3-fluorophenyl)carbamoyl]pyridine-2-carboxylate
CID 3926848
6-(azepane-1-carbonyl)-N-(2,6-dichlorophenyl)pyridine-2-carboxamide
CID 109099941
N-(2,6-dichlorophenyl)-6-(piperidine-1-carbonyl)pyridine-2-carboxamide
CID 109095252
methyl 4-[[6-(azepane-1-carbonyl)pyridine-2-carbonyl]amino]benzoate
CID 109099926
N-(2-chlorophenyl)-6-(pyrrolidine-1-carbonyl)pyridine-2-carboxamide
CID 109094857
[4-(3-fluoroanilino)-2-pyridinyl]-pyrrolidin-1-ylmethanone
CID 109203769

Frequently Asked Questions

What is the IUPAC name of N-(3-fluorophenyl)-6-(pyrrolidine-1-carbonyl)pyridine-2-carboxamide?
The IUPAC name of N-(3-fluorophenyl)-6-(pyrrolidine-1-carbonyl)pyridine-2-carboxamide (CID 109094901) is N-(3-fluorophenyl)-6-(pyrrolidine-1-carbonyl)pyridine-2-carboxamide.
What is the SMILES notation for N-(3-fluorophenyl)-6-(pyrrolidine-1-carbonyl)pyridine-2-carboxamide?
The canonical SMILES for N-(3-fluorophenyl)-6-(pyrrolidine-1-carbonyl)pyridine-2-carboxamide is O=C(Nc1cccc(F)c1)c1cccc(C(=O)N2CCCC2)n1.
What is the InChIKey of N-(3-fluorophenyl)-6-(pyrrolidine-1-carbonyl)pyridine-2-carboxamide?
The InChIKey is USTGUOIJZKUEIG-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H16FN3O2/c18-12-5-3-6-13(11-12)19-16(22)14-7-4-8-15(20-14)17(23)21-9-1-2-10-21/h3-8,11H,1-2,9-10H2,(H,19,22).
What are the key properties of N-(3-fluorophenyl)-6-(pyrrolidine-1-carbonyl)pyridine-2-carboxamide?
N-(3-fluorophenyl)-6-(pyrrolidine-1-carbonyl)pyridine-2-carboxamide has a molecular weight of 313.33 g/mol, XLogP of 2.71, 3 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-(3-fluorophenyl)-6-(pyrrolidine-1-carbonyl)pyridine-2-carboxamide is sourced from PubChem (CID 109094901), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).