2-amino-N-(2,6-diethylphenyl)-3-fluoropyridine-4-carboxamide

C16H18FN3O — CID 105384043

IUPAC2-amino-N-(2,6-diethylphenyl)-3-fluoropyridine-4-carboxamide
SMILESCCc1cccc(CC)c1NC(=O)c1ccnc(N)c1F
InChIInChI=1S/C16H18FN3O/c1-3-10-6-5-7-11(4-2)14(10)20-16(21)12-8-9-19-15(18)13(12)17/h5-9H,3-4H2,1-2H3,(H2,18,19)(H,20,21)
InChIKeyYNHIULIXPHZACO-UHFFFAOYSA-N
MW287.34 g/mol
LogP3.18
Rot. Bonds4

About 2-amino-N-(2,6-diethylphenyl)-3-fluoropyridine-4-carboxamide

2-amino-N-(2,6-diethylphenyl)-3-fluoropyridine-4-carboxamide (PubChem CID 105384043) has the molecular formula C16H18FN3O and a molecular weight of 287.34 g/mol. Its IUPAC name is 2-amino-N-(2,6-diethylphenyl)-3-fluoropyridine-4-carboxamide.

Molecular Properties

Compound Name2-amino-N-(2,6-diethylphenyl)-3-fluoropyridine-4-carboxamide
PubChem CID105384043
Molecular FormulaC16H18FN3O
Molecular Weight287.34 g/mol
Exact Mass287.14
IUPAC Name2-amino-N-(2,6-diethylphenyl)-3-fluoropyridine-4-carboxamide
SMILESCCc1cccc(CC)c1NC(=O)c1ccnc(N)c1F
InChIInChI=1S/C16H18FN3O/c1-3-10-6-5-7-11(4-2)14(10)20-16(21)12-8-9-19-15(18)13(12)17/h5-9H,3-4H2,1-2H3,(H2,18,19)(H,20,21)
InChIKeyYNHIULIXPHZACO-UHFFFAOYSA-N
XLogP3.18
TPSA68.01 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500287.34
LogP ≤ 53.18
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

2-amino-N-(2,6-difluorophenyl)-3-fluoropyridine-4-carboxamide
CID 105384666
2-amino-N-(4-ethylphenyl)-3-fluoropyridine-4-carboxamide
CID 105384537
2-amino-3-fluoro-N-[2-(2-methoxyethyl)phenyl]pyridine-4-carboxamide
CID 102907943
2-amino-N-(2-ethoxyphenyl)-3-fluoropyridine-4-carboxamide
CID 105384040
2-amino-3-fluoro-N-pyridin-2-ylpyridine-4-carboxamide
CID 105384358
4-amino-N-(2,6-diethylphenyl)pyridine-3-carboxamide
CID 81235051
2-amino-3-fluoro-N-(2-methylbutan-2-yl)pyridine-4-carboxamide
CID 105384278
N-(2,6-diethylphenyl)-2-hydrazinylpyridine-3-carboxamide
CID 62237949
2-amino-3-fluoro-N-quinolin-8-ylpyridine-4-carboxamide
CID 105384038
2-chloro-N-(2,6-diethylphenyl)-4,5-difluorobenzamide
CID 1252541
2-amino-N-(3-ethylpentan-2-yl)-3-fluoropyridine-4-carboxamide
CID 105386392
2-amino-3-fluoro-N-hexan-2-ylpyridine-4-carboxamide
CID 105385959

Frequently Asked Questions

What is the IUPAC name of 2-amino-N-(2,6-diethylphenyl)-3-fluoropyridine-4-carboxamide?
The IUPAC name of 2-amino-N-(2,6-diethylphenyl)-3-fluoropyridine-4-carboxamide (CID 105384043) is 2-amino-N-(2,6-diethylphenyl)-3-fluoropyridine-4-carboxamide.
What is the SMILES notation for 2-amino-N-(2,6-diethylphenyl)-3-fluoropyridine-4-carboxamide?
The canonical SMILES for 2-amino-N-(2,6-diethylphenyl)-3-fluoropyridine-4-carboxamide is CCc1cccc(CC)c1NC(=O)c1ccnc(N)c1F.
What is the InChIKey of 2-amino-N-(2,6-diethylphenyl)-3-fluoropyridine-4-carboxamide?
The InChIKey is YNHIULIXPHZACO-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H18FN3O/c1-3-10-6-5-7-11(4-2)14(10)20-16(21)12-8-9-19-15(18)13(12)17/h5-9H,3-4H2,1-2H3,(H2,18,19)(H,20,21).
What are the key properties of 2-amino-N-(2,6-diethylphenyl)-3-fluoropyridine-4-carboxamide?
2-amino-N-(2,6-diethylphenyl)-3-fluoropyridine-4-carboxamide has a molecular weight of 287.34 g/mol, XLogP of 3.18, 4 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-amino-N-(2,6-diethylphenyl)-3-fluoropyridine-4-carboxamide is sourced from PubChem (CID 105384043), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).