2-N,6-N-bis[1-(4-fluorophenyl)ethyl]pyridine-2,6-dicarboxamide

C23H21F2N3O2 — CID 46430353

IUPAC2-N,6-N-bis[1-(4-fluorophenyl)ethyl]pyridine-2,6-dicarboxamide
SMILESCC(NC(=O)c1cccc(C(=O)NC(C)c2ccc(F)cc2)n1)c1ccc(F)cc1
InChIInChI=1S/C23H21F2N3O2/c1-14(16-6-10-18(24)11-7-16)26-22(29)20-4-3-5-21(28-20)23(30)27-15(2)17-8-12-19(25)13-9-17/h3-15H,1-2H3,(H,26,29)(H,27,30)
InChIKeyHJUQUQUYIMXAOI-UHFFFAOYSA-N
MW409.44 g/mol
LogP4.34
Rot. Bonds6

About 2-N,6-N-bis[1-(4-fluorophenyl)ethyl]pyridine-2,6-dicarboxamide

2-N,6-N-bis[1-(4-fluorophenyl)ethyl]pyridine-2,6-dicarboxamide (PubChem CID 46430353) has the molecular formula C23H21F2N3O2 and a molecular weight of 409.44 g/mol. Its IUPAC name is 2-N,6-N-bis[1-(4-fluorophenyl)ethyl]pyridine-2,6-dicarboxamide.

Molecular Properties

Compound Name2-N,6-N-bis[1-(4-fluorophenyl)ethyl]pyridine-2,6-dicarboxamide
PubChem CID46430353
Molecular FormulaC23H21F2N3O2
Molecular Weight409.44 g/mol
Exact Mass409.16
IUPAC Name2-N,6-N-bis[1-(4-fluorophenyl)ethyl]pyridine-2,6-dicarboxamide
SMILESCC(NC(=O)c1cccc(C(=O)NC(C)c2ccc(F)cc2)n1)c1ccc(F)cc1
InChIInChI=1S/C23H21F2N3O2/c1-14(16-6-10-18(24)11-7-16)26-22(29)20-4-3-5-21(28-20)23(30)27-15(2)17-8-12-19(25)13-9-17/h3-15H,1-2H3,(H,26,29)(H,27,30)
InChIKeyHJUQUQUYIMXAOI-UHFFFAOYSA-N
XLogP4.34
TPSA71.09 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds6
Heavy Atoms30
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500409.44
LogP ≤ 54.34
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

2-N-[(1S)-1-phenylethyl]-6-N-[(1R)-1-phenylethyl]pyridine-2,6-dicarboxamide
CID 139136791
6-fluoro-N-[1-(4-methoxyphenyl)ethyl]pyridine-2-carboxamide
CID 115497979
6-N-[1-(4-methylsulfonylphenyl)ethyl]-2-N-propan-2-ylpyridine-2,6-dicarboxamide
CID 25024948
2-amino-N-[1-(4-fluorophenyl)ethyl]-1,3-thiazole-4-carboxamide
CID 55116256
6-amino-N-[1-(4-fluorophenyl)ethyl]pyridazine-3-carboxamide
CID 55041899
6-bromo-N-(1-phenylethyl)pyridine-2-carboxamide
CID 103874025
N-[1-(4-methoxyphenyl)ethyl]-6-methylpyridine-2-carboxamide
CID 110462509
2-(1-aminoethyl)-N-[(1S)-1-(4-fluorophenyl)ethyl]-1,3-thiazole-4-carboxamide
CID 81349122
N-[1-(4-fluorophenyl)ethyl]-6-oxo-2-phenyl-1H-pyrimidine-4-carboxamide
CID 136982729
2-N-[(4-fluorophenyl)methyl]-6-N-propan-2-ylpyridine-2,6-dicarboxamide
CID 109093645
N-[(1S)-1-(4-fluorophenyl)ethyl]-6-methylimidazo[1,2-a]pyridine-2-carboxamide
CID 95051261
3,5-difluoro-N-[1-(4-fluorophenyl)ethyl]benzamide
CID 43906716

Frequently Asked Questions

What is the IUPAC name of 2-N,6-N-bis[1-(4-fluorophenyl)ethyl]pyridine-2,6-dicarboxamide?
The IUPAC name of 2-N,6-N-bis[1-(4-fluorophenyl)ethyl]pyridine-2,6-dicarboxamide (CID 46430353) is 2-N,6-N-bis[1-(4-fluorophenyl)ethyl]pyridine-2,6-dicarboxamide.
What is the SMILES notation for 2-N,6-N-bis[1-(4-fluorophenyl)ethyl]pyridine-2,6-dicarboxamide?
The canonical SMILES for 2-N,6-N-bis[1-(4-fluorophenyl)ethyl]pyridine-2,6-dicarboxamide is CC(NC(=O)c1cccc(C(=O)NC(C)c2ccc(F)cc2)n1)c1ccc(F)cc1.
What is the InChIKey of 2-N,6-N-bis[1-(4-fluorophenyl)ethyl]pyridine-2,6-dicarboxamide?
The InChIKey is HJUQUQUYIMXAOI-UHFFFAOYSA-N. The full InChI is InChI=1S/C23H21F2N3O2/c1-14(16-6-10-18(24)11-7-16)26-22(29)20-4-3-5-21(28-20)23(30)27-15(2)17-8-12-19(25)13-9-17/h3-15H,1-2H3,(H,26,29)(H,27,30).
What are the key properties of 2-N,6-N-bis[1-(4-fluorophenyl)ethyl]pyridine-2,6-dicarboxamide?
2-N,6-N-bis[1-(4-fluorophenyl)ethyl]pyridine-2,6-dicarboxamide has a molecular weight of 409.44 g/mol, XLogP of 4.34, 6 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-N,6-N-bis[1-(4-fluorophenyl)ethyl]pyridine-2,6-dicarboxamide is sourced from PubChem (CID 46430353), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).