N-(2-fluoro-5-pyrrolidin-1-ylphenyl)pyridine-3-carboxamide

C16H16FN3O — CID 110361821

IUPACN-(2-fluoro-5-pyrrolidin-1-ylphenyl)pyridine-3-carboxamide
SMILESO=C(Nc1cc(N2CCCC2)ccc1F)c1cccnc1
InChIInChI=1S/C16H16FN3O/c17-14-6-5-13(20-8-1-2-9-20)10-15(14)19-16(21)12-4-3-7-18-11-12/h3-7,10-11H,1-2,8-9H2,(H,19,21)
InChIKeyWZBBLDLUISICHI-UHFFFAOYSA-N
MW285.32 g/mol
LogP3.07
Rot. Bonds3

About N-(2-fluoro-5-pyrrolidin-1-ylphenyl)pyridine-3-carboxamide

N-(2-fluoro-5-pyrrolidin-1-ylphenyl)pyridine-3-carboxamide (PubChem CID 110361821) has the molecular formula C16H16FN3O and a molecular weight of 285.32 g/mol. Its IUPAC name is N-(2-fluoro-5-pyrrolidin-1-ylphenyl)pyridine-3-carboxamide.

Molecular Properties

Compound NameN-(2-fluoro-5-pyrrolidin-1-ylphenyl)pyridine-3-carboxamide
PubChem CID110361821
Molecular FormulaC16H16FN3O
Molecular Weight285.32 g/mol
Exact Mass285.13
IUPAC NameN-(2-fluoro-5-pyrrolidin-1-ylphenyl)pyridine-3-carboxamide
SMILESO=C(Nc1cc(N2CCCC2)ccc1F)c1cccnc1
InChIInChI=1S/C16H16FN3O/c17-14-6-5-13(20-8-1-2-9-20)10-15(14)19-16(21)12-4-3-7-18-11-12/h3-7,10-11H,1-2,8-9H2,(H,19,21)
InChIKeyWZBBLDLUISICHI-UHFFFAOYSA-N
XLogP3.07
TPSA45.23 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500285.32
LogP ≤ 53.07
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

N-(2-fluoro-5-piperidin-1-ylphenyl)pyridine-3-carboxamide
CID 110362254
N-(5-bromo-2-fluorophenyl)pyridine-3-carboxamide;hydrochloride
CID 110779489
N-(2,4-dimorpholin-4-ylphenyl)pyridine-3-carboxamide
CID 24676967
N-[2-(azepan-1-yl)phenyl]pyridine-3-carboxamide
CID 38282179
N-(2-fluoro-5-pyrrolidin-1-ylphenyl)thiophene-2-carboxamide
CID 110361789
N-(2-fluoro-5-pyrrolidin-1-ylphenyl)-3,4-dimethoxybenzamide
CID 110361803
N-(2-fluoro-5-piperidin-1-ylphenyl)furan-2-carboxamide
CID 110362234
N-(2-fluoro-5-piperidin-1-ylphenyl)-3,4,5-trimethoxybenzamide
CID 110362244
N-(2-fluoro-5-pyrrolidin-1-ylphenyl)-2-methylpropanamide
CID 110361779
N-[2-[[2-(dimethylamino)phenyl]methylsulfinyl]-4-pyrrolidin-1-ylphenyl]pyridine-3-carboxamide
CID 139694449
N-(2-fluoro-5-piperidin-1-ylphenyl)propanamide
CID 110362225
N-(2-fluoro-5-pyrrolidin-1-ylphenyl)cyclohexanecarboxamide
CID 110361783

Frequently Asked Questions

What is the IUPAC name of N-(2-fluoro-5-pyrrolidin-1-ylphenyl)pyridine-3-carboxamide?
The IUPAC name of N-(2-fluoro-5-pyrrolidin-1-ylphenyl)pyridine-3-carboxamide (CID 110361821) is N-(2-fluoro-5-pyrrolidin-1-ylphenyl)pyridine-3-carboxamide.
What is the SMILES notation for N-(2-fluoro-5-pyrrolidin-1-ylphenyl)pyridine-3-carboxamide?
The canonical SMILES for N-(2-fluoro-5-pyrrolidin-1-ylphenyl)pyridine-3-carboxamide is O=C(Nc1cc(N2CCCC2)ccc1F)c1cccnc1.
What is the InChIKey of N-(2-fluoro-5-pyrrolidin-1-ylphenyl)pyridine-3-carboxamide?
The InChIKey is WZBBLDLUISICHI-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H16FN3O/c17-14-6-5-13(20-8-1-2-9-20)10-15(14)19-16(21)12-4-3-7-18-11-12/h3-7,10-11H,1-2,8-9H2,(H,19,21).
What are the key properties of N-(2-fluoro-5-pyrrolidin-1-ylphenyl)pyridine-3-carboxamide?
N-(2-fluoro-5-pyrrolidin-1-ylphenyl)pyridine-3-carboxamide has a molecular weight of 285.32 g/mol, XLogP of 3.07, 3 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2-fluoro-5-pyrrolidin-1-ylphenyl)pyridine-3-carboxamide is sourced from PubChem (CID 110361821), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).