2-N-(3-chloro-4-fluorophenyl)-4-N-(3-methoxyphenyl)pyridine-2,4-dicarboxamide

C20H15ClFN3O3 — CID 109092970

IUPAC2-N-(3-chloro-4-fluorophenyl)-4-N-(3-methoxyphenyl)pyridine-2,4-dicarboxamide
SMILESCOc1cccc(NC(=O)c2ccnc(C(=O)Nc3ccc(F)c(Cl)c3)c2)c1
InChIInChI=1S/C20H15ClFN3O3/c1-28-15-4-2-3-13(10-15)24-19(26)12-7-8-23-18(9-12)20(27)25-14-5-6-17(22)16(21)11-14/h2-11H,1H3,(H,24,26)(H,25,27)
InChIKeyFVPURPGKQSYZGP-UHFFFAOYSA-N
MW399.81 g/mol
LogP4.39
Rot. Bonds5

About 2-N-(3-chloro-4-fluorophenyl)-4-N-(3-methoxyphenyl)pyridine-2,4-dicarboxamide

2-N-(3-chloro-4-fluorophenyl)-4-N-(3-methoxyphenyl)pyridine-2,4-dicarboxamide (PubChem CID 109092970) has the molecular formula C20H15ClFN3O3 and a molecular weight of 399.81 g/mol. Its IUPAC name is 2-N-(3-chloro-4-fluorophenyl)-4-N-(3-methoxyphenyl)pyridine-2,4-dicarboxamide.

Molecular Properties

Compound Name2-N-(3-chloro-4-fluorophenyl)-4-N-(3-methoxyphenyl)pyridine-2,4-dicarboxamide
PubChem CID109092970
Molecular FormulaC20H15ClFN3O3
Molecular Weight399.81 g/mol
Exact Mass399.08
IUPAC Name2-N-(3-chloro-4-fluorophenyl)-4-N-(3-methoxyphenyl)pyridine-2,4-dicarboxamide
SMILESCOc1cccc(NC(=O)c2ccnc(C(=O)Nc3ccc(F)c(Cl)c3)c2)c1
InChIInChI=1S/C20H15ClFN3O3/c1-28-15-4-2-3-13(10-15)24-19(26)12-7-8-23-18(9-12)20(27)25-14-5-6-17(22)16(21)11-14/h2-11H,1H3,(H,24,26)(H,25,27)
InChIKeyFVPURPGKQSYZGP-UHFFFAOYSA-N
XLogP4.39
TPSA80.32 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms28
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500399.81
LogP ≤ 54.39
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Related Compounds

4-N-(3,4-difluorophenyl)-2-N-(3-methoxyphenyl)pyridine-2,4-dicarboxamide
CID 109093066
4-N-(3-chlorophenyl)-2-N-(3-methoxyphenyl)pyridine-2,4-dicarboxamide
CID 109092816
2-N-(3-chloro-4-fluorophenyl)-4-N-(3-fluorophenyl)pyridine-2,4-dicarboxamide
CID 109092972
2-N-(3-chloro-4-fluorophenyl)-4-N-(2-methoxyphenyl)pyridine-2,4-dicarboxamide
CID 109092969
2-N-(4-chloro-2-methylphenyl)-4-N-(3-methoxyphenyl)pyridine-2,4-dicarboxamide
CID 109092938
4-N-(3-chloro-4-fluorophenyl)-2-N-(4-methylphenyl)pyridine-2,4-dicarboxamide
CID 109091357
4-N-(3-chloro-4-fluorophenyl)-2-N-(2-fluorophenyl)pyridine-2,4-dicarboxamide
CID 109092643
2-N-(3-chloro-4-fluorophenyl)-4-N-(2,3-dimethylphenyl)pyridine-2,4-dicarboxamide
CID 109092121
2-N-(4-cyanophenyl)-4-N-(3-methoxyphenyl)pyridine-2,4-dicarboxamide
CID 109093044
2-N-(3-chloro-4-fluorophenyl)-4-N-(2-methylphenyl)pyridine-2,4-dicarboxamide
CID 109091011
4-N-(4-chlorophenyl)-2-N-(4-methoxyphenyl)pyridine-2,4-dicarboxamide
CID 109092859
2-N-(3-methoxyphenyl)-4-N-(2-methylphenyl)pyridine-2,4-dicarboxamide
CID 109091016

Frequently Asked Questions

What is the IUPAC name of 2-N-(3-chloro-4-fluorophenyl)-4-N-(3-methoxyphenyl)pyridine-2,4-dicarboxamide?
The IUPAC name of 2-N-(3-chloro-4-fluorophenyl)-4-N-(3-methoxyphenyl)pyridine-2,4-dicarboxamide (CID 109092970) is 2-N-(3-chloro-4-fluorophenyl)-4-N-(3-methoxyphenyl)pyridine-2,4-dicarboxamide.
What is the SMILES notation for 2-N-(3-chloro-4-fluorophenyl)-4-N-(3-methoxyphenyl)pyridine-2,4-dicarboxamide?
The canonical SMILES for 2-N-(3-chloro-4-fluorophenyl)-4-N-(3-methoxyphenyl)pyridine-2,4-dicarboxamide is COc1cccc(NC(=O)c2ccnc(C(=O)Nc3ccc(F)c(Cl)c3)c2)c1.
What is the InChIKey of 2-N-(3-chloro-4-fluorophenyl)-4-N-(3-methoxyphenyl)pyridine-2,4-dicarboxamide?
The InChIKey is FVPURPGKQSYZGP-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H15ClFN3O3/c1-28-15-4-2-3-13(10-15)24-19(26)12-7-8-23-18(9-12)20(27)25-14-5-6-17(22)16(21)11-14/h2-11H,1H3,(H,24,26)(H,25,27).
What are the key properties of 2-N-(3-chloro-4-fluorophenyl)-4-N-(3-methoxyphenyl)pyridine-2,4-dicarboxamide?
2-N-(3-chloro-4-fluorophenyl)-4-N-(3-methoxyphenyl)pyridine-2,4-dicarboxamide has a molecular weight of 399.81 g/mol, XLogP of 4.39, 5 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-N-(3-chloro-4-fluorophenyl)-4-N-(3-methoxyphenyl)pyridine-2,4-dicarboxamide is sourced from PubChem (CID 109092970), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).