2-(ethylamino)-3-fluoro-N-[1-(furan-2-yl)ethyl]pyridine-4-carboxamide

C14H16FN3O2 — CID 105384882

IUPAC2-(ethylamino)-3-fluoro-N-[1-(furan-2-yl)ethyl]pyridine-4-carboxamide
SMILESCCNc1nccc(C(=O)NC(C)c2ccco2)c1F
InChIInChI=1S/C14H16FN3O2/c1-3-16-13-12(15)10(6-7-17-13)14(19)18-9(2)11-5-4-8-20-11/h4-9H,3H2,1-2H3,(H,16,17)(H,18,19)
InChIKeyAKYYUXDWJPLOFX-UHFFFAOYSA-N
MW277.30 g/mol
LogP2.74
Rot. Bonds5

About 2-(ethylamino)-3-fluoro-N-[1-(furan-2-yl)ethyl]pyridine-4-carboxamide

2-(ethylamino)-3-fluoro-N-[1-(furan-2-yl)ethyl]pyridine-4-carboxamide (PubChem CID 105384882) has the molecular formula C14H16FN3O2 and a molecular weight of 277.30 g/mol. Its IUPAC name is 2-(ethylamino)-3-fluoro-N-[1-(furan-2-yl)ethyl]pyridine-4-carboxamide.

Molecular Properties

Compound Name2-(ethylamino)-3-fluoro-N-[1-(furan-2-yl)ethyl]pyridine-4-carboxamide
PubChem CID105384882
Molecular FormulaC14H16FN3O2
Molecular Weight277.30 g/mol
Exact Mass277.12
IUPAC Name2-(ethylamino)-3-fluoro-N-[1-(furan-2-yl)ethyl]pyridine-4-carboxamide
SMILESCCNc1nccc(C(=O)NC(C)c2ccco2)c1F
InChIInChI=1S/C14H16FN3O2/c1-3-16-13-12(15)10(6-7-17-13)14(19)18-9(2)11-5-4-8-20-11/h4-9H,3H2,1-2H3,(H,16,17)(H,18,19)
InChIKeyAKYYUXDWJPLOFX-UHFFFAOYSA-N
XLogP2.74
TPSA67.16 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500277.30
LogP ≤ 52.74
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
2-(ethylamino)-N-[1-(furan-2-yl)ethyl]benzamide
CID 62169362
N-[1-(dimethylamino)-3-methylbutan-2-yl]-2-(ethylamino)-3-fluoropyridine-4-carboxamide
CID 105385519
2-(ethylamino)-3-fluoro-N-(1-methoxy-3-methylbutan-2-yl)pyridine-4-carboxamide
CID 105386649
N-(2,2-difluoroethyl)-2-(ethylamino)-3-fluoropyridine-4-carboxamide
CID 105387079
2-(ethylamino)-3-fluoro-N-pyridazin-3-ylpyridine-4-carboxamide
CID 105387662
2-(ethylamino)-N-[1-(furan-2-yl)ethyl]-5-methylbenzamide
CID 62509162
4-(ethylamino)-N-[1-(furan-2-yl)ethyl]benzamide
CID 62169194
2-amino-N-[1-(furan-2-yl)ethyl]pyridine-3-carboxamide
CID 62073819
N-[2-(tert-butylamino)-2-oxoethyl]-2-(ethylamino)-3-fluoropyridine-4-carboxamide
CID 105387072
N-[1-(ethylamino)-1-oxopropan-2-yl]-3-fluoro-2-(methylamino)pyridine-4-carboxamide
CID 105385912
2-(ethylamino)-3-fluoro-N-[2-(methylamino)-2-oxoethyl]pyridine-4-carboxamide
CID 105384864

Frequently Asked Questions

What is the IUPAC name of 2-(ethylamino)-3-fluoro-N-[1-(furan-2-yl)ethyl]pyridine-4-carboxamide?
The IUPAC name of 2-(ethylamino)-3-fluoro-N-[1-(furan-2-yl)ethyl]pyridine-4-carboxamide (CID 105384882) is 2-(ethylamino)-3-fluoro-N-[1-(furan-2-yl)ethyl]pyridine-4-carboxamide.
What is the SMILES notation for 2-(ethylamino)-3-fluoro-N-[1-(furan-2-yl)ethyl]pyridine-4-carboxamide?
The canonical SMILES for 2-(ethylamino)-3-fluoro-N-[1-(furan-2-yl)ethyl]pyridine-4-carboxamide is CCNc1nccc(C(=O)NC(C)c2ccco2)c1F.
What is the InChIKey of 2-(ethylamino)-3-fluoro-N-[1-(furan-2-yl)ethyl]pyridine-4-carboxamide?
The InChIKey is AKYYUXDWJPLOFX-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H16FN3O2/c1-3-16-13-12(15)10(6-7-17-13)14(19)18-9(2)11-5-4-8-20-11/h4-9H,3H2,1-2H3,(H,16,17)(H,18,19).
What are the key properties of 2-(ethylamino)-3-fluoro-N-[1-(furan-2-yl)ethyl]pyridine-4-carboxamide?
2-(ethylamino)-3-fluoro-N-[1-(furan-2-yl)ethyl]pyridine-4-carboxamide has a molecular weight of 277.30 g/mol, XLogP of 2.74, 5 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(ethylamino)-3-fluoro-N-[1-(furan-2-yl)ethyl]pyridine-4-carboxamide is sourced from PubChem (CID 105384882), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).