N-(3,5-difluorophenyl)-3-(ethylamino)pyridine-4-carboxamide

C14H13F2N3O — CID 105068357

IUPACN-(3,5-difluorophenyl)-3-(ethylamino)pyridine-4-carboxamide
SMILESCCNc1cnccc1C(=O)Nc1cc(F)cc(F)c1
InChIInChI=1S/C14H13F2N3O/c1-2-18-13-8-17-4-3-12(13)14(20)19-11-6-9(15)5-10(16)7-11/h3-8,18H,2H2,1H3,(H,19,20)
InChIKeyGOOVWOHURKUBAY-UHFFFAOYSA-N
MW277.27 g/mol
LogP3.04
Rot. Bonds4

About N-(3,5-difluorophenyl)-3-(ethylamino)pyridine-4-carboxamide

N-(3,5-difluorophenyl)-3-(ethylamino)pyridine-4-carboxamide (PubChem CID 105068357) has the molecular formula C14H13F2N3O and a molecular weight of 277.27 g/mol. Its IUPAC name is N-(3,5-difluorophenyl)-3-(ethylamino)pyridine-4-carboxamide.

Molecular Properties

Compound NameN-(3,5-difluorophenyl)-3-(ethylamino)pyridine-4-carboxamide
PubChem CID105068357
Molecular FormulaC14H13F2N3O
Molecular Weight277.27 g/mol
Exact Mass277.10
IUPAC NameN-(3,5-difluorophenyl)-3-(ethylamino)pyridine-4-carboxamide
SMILESCCNc1cnccc1C(=O)Nc1cc(F)cc(F)c1
InChIInChI=1S/C14H13F2N3O/c1-2-18-13-8-17-4-3-12(13)14(20)19-11-6-9(15)5-10(16)7-11/h3-8,18H,2H2,1H3,(H,19,20)
InChIKeyGOOVWOHURKUBAY-UHFFFAOYSA-N
XLogP3.04
TPSA54.02 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500277.27
LogP ≤ 53.04
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

4-(ethylamino)-N-(4-fluorophenyl)pyridine-3-carboxamide
CID 81236169
3-(ethylamino)-N-thiophen-3-ylpyridine-4-carboxamide
CID 105070563
N-(4-bromo-3-chlorophenyl)-3-(ethylamino)pyridine-4-carboxamide
CID 107616662
N-(2-cyano-4-fluorophenyl)-3-(ethylamino)pyridine-4-carboxamide
CID 105070921
N-(4-ethoxyphenyl)-3-(ethylamino)pyridine-4-carboxamide
CID 105067886
N-(4-cyano-2-fluorophenyl)-3-(ethylamino)pyridine-4-carboxamide
CID 105070875
N-(3-bromo-4-fluorophenyl)-3-(propylamino)pyridine-4-carboxamide
CID 105071177
N-(2-chloro-4-methylphenyl)-3-(ethylamino)pyridine-4-carboxamide
CID 105068441
3-(ethylamino)-N-(4-fluorophenyl)-N-methylpyridine-4-carboxamide
CID 105069144
N-(3-chloro-5-fluorophenyl)-4-(propylamino)pyridine-3-carboxamide
CID 107370476
3-(ethylamino)-N-piperidin-1-ylpyridine-4-carboxamide
CID 105070981
4-(ethylamino)-N-(5-fluoro-2-methylphenyl)pyridine-3-carboxamide
CID 81236730

Frequently Asked Questions

What is the IUPAC name of N-(3,5-difluorophenyl)-3-(ethylamino)pyridine-4-carboxamide?
The IUPAC name of N-(3,5-difluorophenyl)-3-(ethylamino)pyridine-4-carboxamide (CID 105068357) is N-(3,5-difluorophenyl)-3-(ethylamino)pyridine-4-carboxamide.
What is the SMILES notation for N-(3,5-difluorophenyl)-3-(ethylamino)pyridine-4-carboxamide?
The canonical SMILES for N-(3,5-difluorophenyl)-3-(ethylamino)pyridine-4-carboxamide is CCNc1cnccc1C(=O)Nc1cc(F)cc(F)c1.
What is the InChIKey of N-(3,5-difluorophenyl)-3-(ethylamino)pyridine-4-carboxamide?
The InChIKey is GOOVWOHURKUBAY-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H13F2N3O/c1-2-18-13-8-17-4-3-12(13)14(20)19-11-6-9(15)5-10(16)7-11/h3-8,18H,2H2,1H3,(H,19,20).
What are the key properties of N-(3,5-difluorophenyl)-3-(ethylamino)pyridine-4-carboxamide?
N-(3,5-difluorophenyl)-3-(ethylamino)pyridine-4-carboxamide has a molecular weight of 277.27 g/mol, XLogP of 3.04, 4 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-(3,5-difluorophenyl)-3-(ethylamino)pyridine-4-carboxamide is sourced from PubChem (CID 105068357), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).