5-amino-N-[1-(3-fluorophenyl)ethyl]pyridine-2-carboxamide

C14H14FN3O — CID 81317430

IUPAC5-amino-N-[1-(3-fluorophenyl)ethyl]pyridine-2-carboxamide
SMILESCC(NC(=O)c1ccc(N)cn1)c1cccc(F)c1
InChIInChI=1S/C14H14FN3O/c1-9(10-3-2-4-11(15)7-10)18-14(19)13-6-5-12(16)8-17-13/h2-9H,16H2,1H3,(H,18,19)
InChIKeySOLCPHDSGHMYBO-UHFFFAOYSA-N
MW259.28 g/mol
LogP2.29
Rot. Bonds3

About 5-amino-N-[1-(3-fluorophenyl)ethyl]pyridine-2-carboxamide

5-amino-N-[1-(3-fluorophenyl)ethyl]pyridine-2-carboxamide (PubChem CID 81317430) has the molecular formula C14H14FN3O and a molecular weight of 259.28 g/mol. Its IUPAC name is 5-amino-N-[1-(3-fluorophenyl)ethyl]pyridine-2-carboxamide.

Molecular Properties

Compound Name5-amino-N-[1-(3-fluorophenyl)ethyl]pyridine-2-carboxamide
PubChem CID81317430
Molecular FormulaC14H14FN3O
Molecular Weight259.28 g/mol
Exact Mass259.11
IUPAC Name5-amino-N-[1-(3-fluorophenyl)ethyl]pyridine-2-carboxamide
SMILESCC(NC(=O)c1ccc(N)cn1)c1cccc(F)c1
InChIInChI=1S/C14H14FN3O/c1-9(10-3-2-4-11(15)7-10)18-14(19)13-6-5-12(16)8-17-13/h2-9H,16H2,1H3,(H,18,19)
InChIKeySOLCPHDSGHMYBO-UHFFFAOYSA-N
XLogP2.29
TPSA68.01 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500259.28
LogP ≤ 52.29
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

5-chloro-N-[1-(3-fluorophenyl)ethyl]pyrazine-2-carboxamide
CID 107236590
2-(5-amino-2-pyridinyl)-N-[(1S)-1-(3-fluorophenyl)ethyl]acetamide
CID 107339328
N-[1-(3-fluorophenyl)ethyl]-6-hydrazinylpyridazine-3-carboxamide
CID 62247886
N-[1-(3-fluorophenyl)ethyl]-2H-triazole-4-carboxamide
CID 47334811
4-amino-3,5-dichloro-N-[1-(3-fluorophenyl)ethyl]benzamide
CID 82808709
2-amino-3-chloro-N-[1-(3-fluorophenyl)ethyl]benzamide
CID 115540519
5-amino-N-(1-pyridin-2-ylethyl)pyridine-2-carboxamide
CID 81315746
5-amino-N-[1-(furan-2-yl)ethyl]pyridine-2-carboxamide
CID 81316387
4-amino-N-[(1S)-1-(3-fluorophenyl)ethyl]-1,2,5-oxadiazole-3-carboxamide
CID 81365969
4-amino-N-[(1R)-1-(3-fluorophenyl)ethyl]-1,2,5-oxadiazole-3-carboxamide
CID 81364858
N-[(1R)-1-(3-fluorophenyl)ethyl]acetamide
CID 81366934
5-chloro-N-[1-(3-fluorophenyl)ethyl]-6-(methylamino)pyridine-3-carboxamide
CID 62174665

Frequently Asked Questions

What is the IUPAC name of 5-amino-N-[1-(3-fluorophenyl)ethyl]pyridine-2-carboxamide?
The IUPAC name of 5-amino-N-[1-(3-fluorophenyl)ethyl]pyridine-2-carboxamide (CID 81317430) is 5-amino-N-[1-(3-fluorophenyl)ethyl]pyridine-2-carboxamide.
What is the SMILES notation for 5-amino-N-[1-(3-fluorophenyl)ethyl]pyridine-2-carboxamide?
The canonical SMILES for 5-amino-N-[1-(3-fluorophenyl)ethyl]pyridine-2-carboxamide is CC(NC(=O)c1ccc(N)cn1)c1cccc(F)c1.
What is the InChIKey of 5-amino-N-[1-(3-fluorophenyl)ethyl]pyridine-2-carboxamide?
The InChIKey is SOLCPHDSGHMYBO-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H14FN3O/c1-9(10-3-2-4-11(15)7-10)18-14(19)13-6-5-12(16)8-17-13/h2-9H,16H2,1H3,(H,18,19).
What are the key properties of 5-amino-N-[1-(3-fluorophenyl)ethyl]pyridine-2-carboxamide?
5-amino-N-[1-(3-fluorophenyl)ethyl]pyridine-2-carboxamide has a molecular weight of 259.28 g/mol, XLogP of 2.29, 3 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 5-amino-N-[1-(3-fluorophenyl)ethyl]pyridine-2-carboxamide is sourced from PubChem (CID 81317430), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).