6-N-(3-fluorophenyl)-2-N-(4-propan-2-yloxyphenyl)pyridine-2,6-dicarboxamide

C22H20FN3O3 — CID 109100999

IUPAC6-N-(3-fluorophenyl)-2-N-(4-propan-2-yloxyphenyl)pyridine-2,6-dicarboxamide
SMILESCC(C)Oc1ccc(NC(=O)c2cccc(C(=O)Nc3cccc(F)c3)n2)cc1
InChIInChI=1S/C22H20FN3O3/c1-14(2)29-18-11-9-16(10-12-18)24-21(27)19-7-4-8-20(26-19)22(28)25-17-6-3-5-15(23)13-17/h3-14H,1-2H3,(H,24,27)(H,25,28)
InChIKeyCILYFRIFTYOWJF-UHFFFAOYSA-N
MW393.42 g/mol
LogP4.51
Rot. Bonds6

About 6-N-(3-fluorophenyl)-2-N-(4-propan-2-yloxyphenyl)pyridine-2,6-dicarboxamide

6-N-(3-fluorophenyl)-2-N-(4-propan-2-yloxyphenyl)pyridine-2,6-dicarboxamide (PubChem CID 109100999) has the molecular formula C22H20FN3O3 and a molecular weight of 393.42 g/mol. Its IUPAC name is 6-N-(3-fluorophenyl)-2-N-(4-propan-2-yloxyphenyl)pyridine-2,6-dicarboxamide.

Molecular Properties

Compound Name6-N-(3-fluorophenyl)-2-N-(4-propan-2-yloxyphenyl)pyridine-2,6-dicarboxamide
PubChem CID109100999
Molecular FormulaC22H20FN3O3
Molecular Weight393.42 g/mol
Exact Mass393.15
IUPAC Name6-N-(3-fluorophenyl)-2-N-(4-propan-2-yloxyphenyl)pyridine-2,6-dicarboxamide
SMILESCC(C)Oc1ccc(NC(=O)c2cccc(C(=O)Nc3cccc(F)c3)n2)cc1
InChIInChI=1S/C22H20FN3O3/c1-14(2)29-18-11-9-16(10-12-18)24-21(27)19-7-4-8-20(26-19)22(28)25-17-6-3-5-15(23)13-17/h3-14H,1-2H3,(H,24,27)(H,25,28)
InChIKeyCILYFRIFTYOWJF-UHFFFAOYSA-N
XLogP4.51
TPSA80.32 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds6
Heavy Atoms29
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500393.42
LogP ≤ 54.51
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Related Compounds

N-(3-fluorophenyl)-2-(4-propan-2-yloxyanilino)pyrimidine-4-carboxamide
CID 109317996
methyl 6-[(3-fluorophenyl)carbamoyl]pyridine-2-carboxylate
CID 3926848
1-(3-fluorophenyl)-3-(3-propan-2-yloxyphenyl)urea
CID 11716200
6-N-(3-fluorophenyl)-2-N-(2-methoxyethyl)pyridine-2,6-dicarboxamide
CID 109095785
3-N-(4-fluorophenyl)-1-N-(4-propan-2-yloxyphenyl)benzene-1,3-dicarboxamide
CID 109057469
2-(2,4-difluoroanilino)-N-(4-propan-2-yloxyphenyl)pyrimidine-4-carboxamide
CID 109318014
2-N-(3,4-difluorophenyl)-6-N-propan-2-ylpyridine-2,6-dicarboxamide
CID 109093804
6-N-(2-ethylphenyl)-2-N-(3-fluorophenyl)pyridine-2,6-dicarboxamide
CID 109100559
5-(3-fluorophenyl)-N-(4-propan-2-yloxyphenyl)-1,3,4-oxadiazole-2-carboxamide
CID 110392539
6-N-benzyl-2-N-(3-fluorophenyl)-6-N-propan-2-ylpyridine-2,6-dicarboxamide
CID 109099326
N-(3-fluorophenyl)-2-(2-propan-2-yloxyanilino)pyrimidine-4-carboxamide
CID 109317966
N-(3-chlorophenyl)-4-propan-2-yloxybenzamide
CID 823397

Frequently Asked Questions

What is the IUPAC name of 6-N-(3-fluorophenyl)-2-N-(4-propan-2-yloxyphenyl)pyridine-2,6-dicarboxamide?
The IUPAC name of 6-N-(3-fluorophenyl)-2-N-(4-propan-2-yloxyphenyl)pyridine-2,6-dicarboxamide (CID 109100999) is 6-N-(3-fluorophenyl)-2-N-(4-propan-2-yloxyphenyl)pyridine-2,6-dicarboxamide.
What is the SMILES notation for 6-N-(3-fluorophenyl)-2-N-(4-propan-2-yloxyphenyl)pyridine-2,6-dicarboxamide?
The canonical SMILES for 6-N-(3-fluorophenyl)-2-N-(4-propan-2-yloxyphenyl)pyridine-2,6-dicarboxamide is CC(C)Oc1ccc(NC(=O)c2cccc(C(=O)Nc3cccc(F)c3)n2)cc1.
What is the InChIKey of 6-N-(3-fluorophenyl)-2-N-(4-propan-2-yloxyphenyl)pyridine-2,6-dicarboxamide?
The InChIKey is CILYFRIFTYOWJF-UHFFFAOYSA-N. The full InChI is InChI=1S/C22H20FN3O3/c1-14(2)29-18-11-9-16(10-12-18)24-21(27)19-7-4-8-20(26-19)22(28)25-17-6-3-5-15(23)13-17/h3-14H,1-2H3,(H,24,27)(H,25,28).
What are the key properties of 6-N-(3-fluorophenyl)-2-N-(4-propan-2-yloxyphenyl)pyridine-2,6-dicarboxamide?
6-N-(3-fluorophenyl)-2-N-(4-propan-2-yloxyphenyl)pyridine-2,6-dicarboxamide has a molecular weight of 393.42 g/mol, XLogP of 4.51, 6 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 6-N-(3-fluorophenyl)-2-N-(4-propan-2-yloxyphenyl)pyridine-2,6-dicarboxamide is sourced from PubChem (CID 109100999), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).