3-fluoro-N-[2-(furan-2-yl)ethyl]-2-(propylamino)pyridine-4-carboxamide

C15H18FN3O2 — CID 105385394

IUPAC3-fluoro-N-[2-(furan-2-yl)ethyl]-2-(propylamino)pyridine-4-carboxamide
SMILESCCCNc1nccc(C(=O)NCCc2ccco2)c1F
InChIInChI=1S/C15H18FN3O2/c1-2-7-17-14-13(16)12(6-9-18-14)15(20)19-8-5-11-4-3-10-21-11/h3-4,6,9-10H,2,5,7-8H2,1H3,(H,17,18)(H,19,20)
InChIKeyFCJISYRFYXIPRP-UHFFFAOYSA-N
MW291.33 g/mol
LogP2.61
Rot. Bonds7

About 3-fluoro-N-[2-(furan-2-yl)ethyl]-2-(propylamino)pyridine-4-carboxamide

3-fluoro-N-[2-(furan-2-yl)ethyl]-2-(propylamino)pyridine-4-carboxamide (PubChem CID 105385394) has the molecular formula C15H18FN3O2 and a molecular weight of 291.33 g/mol. Its IUPAC name is 3-fluoro-N-[2-(furan-2-yl)ethyl]-2-(propylamino)pyridine-4-carboxamide.

Molecular Properties

Compound Name3-fluoro-N-[2-(furan-2-yl)ethyl]-2-(propylamino)pyridine-4-carboxamide
PubChem CID105385394
Molecular FormulaC15H18FN3O2
Molecular Weight291.33 g/mol
Exact Mass291.14
IUPAC Name3-fluoro-N-[2-(furan-2-yl)ethyl]-2-(propylamino)pyridine-4-carboxamide
SMILESCCCNc1nccc(C(=O)NCCc2ccco2)c1F
InChIInChI=1S/C15H18FN3O2/c1-2-7-17-14-13(16)12(6-9-18-14)15(20)19-8-5-11-4-3-10-21-11/h3-4,6,9-10H,2,5,7-8H2,1H3,(H,17,18)(H,19,20)
InChIKeyFCJISYRFYXIPRP-UHFFFAOYSA-N
XLogP2.61
TPSA67.16 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds7
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500291.33
LogP ≤ 52.61
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Related Compounds

2-(ethylamino)-3-fluoro-N-[2-(furan-2-yl)ethyl]pyridine-4-carboxamide
CID 105385395
N-[2-(furan-2-yl)ethyl]-3-(propylamino)pyridine-4-carboxamide
CID 105069134
3-fluoro-N-(2-methylsulfinylethyl)-2-(propylamino)pyridine-4-carboxamide
CID 105387416
3-fluoro-2-(propylamino)-N-(2,2,2-trifluoroethyl)pyridine-4-carboxamide
CID 105384157
N-[2-(ethylamino)-2-oxoethyl]-3-fluoro-2-(propylamino)pyridine-4-carboxamide
CID 105384867
3-fluoro-N-[(2-methylpyrazol-3-yl)methyl]-2-(propylamino)pyridine-4-carboxamide
CID 105386261
N-[2-(furan-2-yl)ethyl]-5-methyl-2-(propylamino)benzamide
CID 62510582
N-(cyclohexylmethyl)-3-fluoro-2-(propylamino)pyridine-4-carboxamide
CID 105384839
3-fluoro-N-[(5-methyl-1,2,4-oxadiazol-3-yl)methyl]-2-(propylamino)pyridine-4-carboxamide
CID 106408130
N-(2-cyclopropylpropyl)-3-fluoro-2-(propylamino)pyridine-4-carboxamide
CID 105387388
3-fluoro-2-(methylamino)-N-[3-oxo-3-(propylamino)propyl]pyridine-4-carboxamide
CID 105385761
3-fluoro-N-(6-oxo-1H-pyridazin-3-yl)-2-(propylamino)pyridine-4-carboxamide
CID 105387666

Frequently Asked Questions

What is the IUPAC name of 3-fluoro-N-[2-(furan-2-yl)ethyl]-2-(propylamino)pyridine-4-carboxamide?
The IUPAC name of 3-fluoro-N-[2-(furan-2-yl)ethyl]-2-(propylamino)pyridine-4-carboxamide (CID 105385394) is 3-fluoro-N-[2-(furan-2-yl)ethyl]-2-(propylamino)pyridine-4-carboxamide.
What is the SMILES notation for 3-fluoro-N-[2-(furan-2-yl)ethyl]-2-(propylamino)pyridine-4-carboxamide?
The canonical SMILES for 3-fluoro-N-[2-(furan-2-yl)ethyl]-2-(propylamino)pyridine-4-carboxamide is CCCNc1nccc(C(=O)NCCc2ccco2)c1F.
What is the InChIKey of 3-fluoro-N-[2-(furan-2-yl)ethyl]-2-(propylamino)pyridine-4-carboxamide?
The InChIKey is FCJISYRFYXIPRP-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H18FN3O2/c1-2-7-17-14-13(16)12(6-9-18-14)15(20)19-8-5-11-4-3-10-21-11/h3-4,6,9-10H,2,5,7-8H2,1H3,(H,17,18)(H,19,20).
What are the key properties of 3-fluoro-N-[2-(furan-2-yl)ethyl]-2-(propylamino)pyridine-4-carboxamide?
3-fluoro-N-[2-(furan-2-yl)ethyl]-2-(propylamino)pyridine-4-carboxamide has a molecular weight of 291.33 g/mol, XLogP of 2.61, 7 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 3-fluoro-N-[2-(furan-2-yl)ethyl]-2-(propylamino)pyridine-4-carboxamide is sourced from PubChem (CID 105385394), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).