4-[(2-chlorophenyl)methylamino]-N-(2,4-difluorophenyl)pyridine-2-carboxamide

C19H14ClF2N3O — CID 109211770

IUPAC4-[(2-chlorophenyl)methylamino]-N-(2,4-difluorophenyl)pyridine-2-carboxamide
SMILESO=C(Nc1ccc(F)cc1F)c1cc(NCc2ccccc2Cl)ccn1
InChIInChI=1S/C19H14ClF2N3O/c20-15-4-2-1-3-12(15)11-24-14-7-8-23-18(10-14)19(26)25-17-6-5-13(21)9-16(17)22/h1-10H,11H2,(H,23,24)(H,25,26)
InChIKeyQVZWFTUXHIDNFR-UHFFFAOYSA-N
MW373.79 g/mol
LogP4.88
Rot. Bonds5

About 4-[(2-chlorophenyl)methylamino]-N-(2,4-difluorophenyl)pyridine-2-carboxamide

4-[(2-chlorophenyl)methylamino]-N-(2,4-difluorophenyl)pyridine-2-carboxamide (PubChem CID 109211770) has the molecular formula C19H14ClF2N3O and a molecular weight of 373.79 g/mol. Its IUPAC name is 4-[(2-chlorophenyl)methylamino]-N-(2,4-difluorophenyl)pyridine-2-carboxamide.

Molecular Properties

Compound Name4-[(2-chlorophenyl)methylamino]-N-(2,4-difluorophenyl)pyridine-2-carboxamide
PubChem CID109211770
Molecular FormulaC19H14ClF2N3O
Molecular Weight373.79 g/mol
Exact Mass373.08
IUPAC Name4-[(2-chlorophenyl)methylamino]-N-(2,4-difluorophenyl)pyridine-2-carboxamide
SMILESO=C(Nc1ccc(F)cc1F)c1cc(NCc2ccccc2Cl)ccn1
InChIInChI=1S/C19H14ClF2N3O/c20-15-4-2-1-3-12(15)11-24-14-7-8-23-18(10-14)19(26)25-17-6-5-13(21)9-16(17)22/h1-10H,11H2,(H,23,24)(H,25,26)
InChIKeyQVZWFTUXHIDNFR-UHFFFAOYSA-N
XLogP4.88
TPSA54.02 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms26
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500373.79
LogP ≤ 54.88
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 4-[(2-chlorophenyl)methylamino]-N-(2,4-difluorophenyl)pyridine-2-carboxamide?
The IUPAC name of 4-[(2-chlorophenyl)methylamino]-N-(2,4-difluorophenyl)pyridine-2-carboxamide (CID 109211770) is 4-[(2-chlorophenyl)methylamino]-N-(2,4-difluorophenyl)pyridine-2-carboxamide.
What is the SMILES notation for 4-[(2-chlorophenyl)methylamino]-N-(2,4-difluorophenyl)pyridine-2-carboxamide?
The canonical SMILES for 4-[(2-chlorophenyl)methylamino]-N-(2,4-difluorophenyl)pyridine-2-carboxamide is O=C(Nc1ccc(F)cc1F)c1cc(NCc2ccccc2Cl)ccn1.
What is the InChIKey of 4-[(2-chlorophenyl)methylamino]-N-(2,4-difluorophenyl)pyridine-2-carboxamide?
The InChIKey is QVZWFTUXHIDNFR-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H14ClF2N3O/c20-15-4-2-1-3-12(15)11-24-14-7-8-23-18(10-14)19(26)25-17-6-5-13(21)9-16(17)22/h1-10H,11H2,(H,23,24)(H,25,26).
What are the key properties of 4-[(2-chlorophenyl)methylamino]-N-(2,4-difluorophenyl)pyridine-2-carboxamide?
4-[(2-chlorophenyl)methylamino]-N-(2,4-difluorophenyl)pyridine-2-carboxamide has a molecular weight of 373.79 g/mol, XLogP of 4.88, 5 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 4-[(2-chlorophenyl)methylamino]-N-(2,4-difluorophenyl)pyridine-2-carboxamide is sourced from PubChem (CID 109211770), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).