6-N-butan-2-yl-2-N-[(2-fluorophenyl)methyl]pyridine-2,6-dicarboxamide

C18H20FN3O2 — CID 109094593

IUPAC6-N-butan-2-yl-2-N-[(2-fluorophenyl)methyl]pyridine-2,6-dicarboxamide
SMILESCCC(C)NC(=O)c1cccc(C(=O)NCc2ccccc2F)n1
InChIInChI=1S/C18H20FN3O2/c1-3-12(2)21-18(24)16-10-6-9-15(22-16)17(23)20-11-13-7-4-5-8-14(13)19/h4-10,12H,3,11H2,1-2H3,(H,20,23)(H,21,24)
InChIKeyOJFWCGCDGMHOHZ-UHFFFAOYSA-N
MW329.38 g/mol
LogP2.68
Rot. Bonds6

About 6-N-butan-2-yl-2-N-[(2-fluorophenyl)methyl]pyridine-2,6-dicarboxamide

6-N-butan-2-yl-2-N-[(2-fluorophenyl)methyl]pyridine-2,6-dicarboxamide (PubChem CID 109094593) has the molecular formula C18H20FN3O2 and a molecular weight of 329.38 g/mol. Its IUPAC name is 6-N-butan-2-yl-2-N-[(2-fluorophenyl)methyl]pyridine-2,6-dicarboxamide.

Molecular Properties

Compound Name6-N-butan-2-yl-2-N-[(2-fluorophenyl)methyl]pyridine-2,6-dicarboxamide
PubChem CID109094593
Molecular FormulaC18H20FN3O2
Molecular Weight329.38 g/mol
Exact Mass329.15
IUPAC Name6-N-butan-2-yl-2-N-[(2-fluorophenyl)methyl]pyridine-2,6-dicarboxamide
SMILESCCC(C)NC(=O)c1cccc(C(=O)NCc2ccccc2F)n1
InChIInChI=1S/C18H20FN3O2/c1-3-12(2)21-18(24)16-10-6-9-15(22-16)17(23)20-11-13-7-4-5-8-14(13)19/h4-10,12H,3,11H2,1-2H3,(H,20,23)(H,21,24)
InChIKeyOJFWCGCDGMHOHZ-UHFFFAOYSA-N
XLogP2.68
TPSA71.09 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds6
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500329.38
LogP ≤ 52.68
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

6-N-butan-2-yl-2-N-[(2-methylphenyl)methyl]pyridine-2,6-dicarboxamide
CID 109094588
6-fluoro-N-[(2-fluorophenyl)methyl]pyridine-2-carboxamide
CID 115496596
2-N-[(2-fluorophenyl)methyl]-6-N-(4-propan-2-ylphenyl)pyridine-2,6-dicarboxamide
CID 109097776
N-[(2-fluorophenyl)methyl]-6-(pyrrolidine-1-carbonyl)pyridine-2-carboxamide
CID 109094778
N-[(2R)-butan-2-yl]-2-(2-fluorophenyl)acetamide
CID 94102090
6-(butan-2-ylamino)-N-[(2-fluorophenyl)methyl]-2-phenylpyrimidine-4-carboxamide
CID 112852508
3-N-butan-2-yl-1-N-[(2-fluorophenyl)methyl]-5,6,7,8-tetrahydroimidazo[1,5-a]pyridine-1,3-dicarboxamide
CID 109073978
2-N-[(2-chlorophenyl)methyl]-6-N-propan-2-ylpyridine-2,6-dicarboxamide
CID 109093646
N-[(2-fluorophenyl)methyl]-6-(4-formylpiperazine-1-carbonyl)pyridine-2-carboxamide
CID 109096898
6-N-butan-2-yl-2-N-(2-ethyl-6-methylphenyl)pyridine-2,6-dicarboxamide
CID 109094666
6-N-butan-2-yl-2-N-[2-(4-methoxyphenoxy)ethyl]pyridine-2,6-dicarboxamide
CID 109094634
6-N-butan-2-yl-2-N-cyclopropylpyridine-2,6-dicarboxamide
CID 109093809

Frequently Asked Questions

What is the IUPAC name of 6-N-butan-2-yl-2-N-[(2-fluorophenyl)methyl]pyridine-2,6-dicarboxamide?
The IUPAC name of 6-N-butan-2-yl-2-N-[(2-fluorophenyl)methyl]pyridine-2,6-dicarboxamide (CID 109094593) is 6-N-butan-2-yl-2-N-[(2-fluorophenyl)methyl]pyridine-2,6-dicarboxamide.
What is the SMILES notation for 6-N-butan-2-yl-2-N-[(2-fluorophenyl)methyl]pyridine-2,6-dicarboxamide?
The canonical SMILES for 6-N-butan-2-yl-2-N-[(2-fluorophenyl)methyl]pyridine-2,6-dicarboxamide is CCC(C)NC(=O)c1cccc(C(=O)NCc2ccccc2F)n1.
What is the InChIKey of 6-N-butan-2-yl-2-N-[(2-fluorophenyl)methyl]pyridine-2,6-dicarboxamide?
The InChIKey is OJFWCGCDGMHOHZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H20FN3O2/c1-3-12(2)21-18(24)16-10-6-9-15(22-16)17(23)20-11-13-7-4-5-8-14(13)19/h4-10,12H,3,11H2,1-2H3,(H,20,23)(H,21,24).
What are the key properties of 6-N-butan-2-yl-2-N-[(2-fluorophenyl)methyl]pyridine-2,6-dicarboxamide?
6-N-butan-2-yl-2-N-[(2-fluorophenyl)methyl]pyridine-2,6-dicarboxamide has a molecular weight of 329.38 g/mol, XLogP of 2.68, 6 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 6-N-butan-2-yl-2-N-[(2-fluorophenyl)methyl]pyridine-2,6-dicarboxamide is sourced from PubChem (CID 109094593), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).