N-[2-(4-chlorophenyl)ethyl]-5-(2,4-difluoroanilino)pyridine-2-carboxamide

C20H16ClF2N3O — CID 109193674

IUPACN-[2-(4-chlorophenyl)ethyl]-5-(2,4-difluoroanilino)pyridine-2-carboxamide
SMILESO=C(NCCc1ccc(Cl)cc1)c1ccc(Nc2ccc(F)cc2F)cn1
InChIInChI=1S/C20H16ClF2N3O/c21-14-3-1-13(2-4-14)9-10-24-20(27)19-8-6-16(12-25-19)26-18-7-5-15(22)11-17(18)23/h1-8,11-12,26H,9-10H2,(H,24,27)
InChIKeyDWWFTTISKGBSBN-UHFFFAOYSA-N
MW387.82 g/mol
LogP4.73
Rot. Bonds6

About N-[2-(4-chlorophenyl)ethyl]-5-(2,4-difluoroanilino)pyridine-2-carboxamide

N-[2-(4-chlorophenyl)ethyl]-5-(2,4-difluoroanilino)pyridine-2-carboxamide (PubChem CID 109193674) has the molecular formula C20H16ClF2N3O and a molecular weight of 387.82 g/mol. Its IUPAC name is N-[2-(4-chlorophenyl)ethyl]-5-(2,4-difluoroanilino)pyridine-2-carboxamide.

Molecular Properties

Compound NameN-[2-(4-chlorophenyl)ethyl]-5-(2,4-difluoroanilino)pyridine-2-carboxamide
PubChem CID109193674
Molecular FormulaC20H16ClF2N3O
Molecular Weight387.82 g/mol
Exact Mass387.09
IUPAC NameN-[2-(4-chlorophenyl)ethyl]-5-(2,4-difluoroanilino)pyridine-2-carboxamide
SMILESO=C(NCCc1ccc(Cl)cc1)c1ccc(Nc2ccc(F)cc2F)cn1
InChIInChI=1S/C20H16ClF2N3O/c21-14-3-1-13(2-4-14)9-10-24-20(27)19-8-6-16(12-25-19)26-18-7-5-15(22)11-17(18)23/h1-8,11-12,26H,9-10H2,(H,24,27)
InChIKeyDWWFTTISKGBSBN-UHFFFAOYSA-N
XLogP4.73
TPSA54.02 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds6
Heavy Atoms27
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500387.82
LogP ≤ 54.73
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

5-[2-(4-chlorophenyl)ethylamino]-N-(2,4-difluorophenyl)pyridine-2-carboxamide
CID 109193713
5-(2,4-difluoroanilino)-N-(3-phenylpropyl)pyridine-2-carboxamide
CID 109194887
5-[2-(4-chlorophenyl)ethylamino]-N-[2-(4-fluorophenyl)ethyl]pyridine-2-carboxamide
CID 109192321
6-(2,4-difluoroanilino)-N-[2-(4-fluorophenyl)ethyl]pyridazine-3-carboxamide
CID 109122195
5-(2,4-difluoroanilino)-N-(4-fluorophenyl)pyridine-2-carboxamide
CID 109198992
5-(3-chloro-4-fluoroanilino)-N-(2-phenylethyl)pyridine-2-carboxamide
CID 109191800
5-(2,4-difluoroanilino)-N-[2-(4-fluorophenyl)ethyl]pyridine-3-carboxamide
CID 109236485
N-[2-(4-chlorophenyl)ethyl]-5-(2-methoxy-5-methylanilino)pyridine-2-carboxamide
CID 109193668
5-(4-chloro-2-methylanilino)-N-[2-(4-methoxyphenyl)ethyl]pyridine-2-carboxamide
CID 109192765
5-(4-fluoroanilino)-N-(2-phenylethyl)pyridine-2-carboxamide
CID 109191792
N-(3-chlorophenyl)-5-(2,4-difluoroanilino)pyridine-2-carboxamide
CID 109199191
N-[2-(4-fluorophenyl)ethyl]-5-(2-methoxy-5-methylanilino)pyridine-2-carboxamide
CID 109192365

Frequently Asked Questions

What is the IUPAC name of N-[2-(4-chlorophenyl)ethyl]-5-(2,4-difluoroanilino)pyridine-2-carboxamide?
The IUPAC name of N-[2-(4-chlorophenyl)ethyl]-5-(2,4-difluoroanilino)pyridine-2-carboxamide (CID 109193674) is N-[2-(4-chlorophenyl)ethyl]-5-(2,4-difluoroanilino)pyridine-2-carboxamide.
What is the SMILES notation for N-[2-(4-chlorophenyl)ethyl]-5-(2,4-difluoroanilino)pyridine-2-carboxamide?
The canonical SMILES for N-[2-(4-chlorophenyl)ethyl]-5-(2,4-difluoroanilino)pyridine-2-carboxamide is O=C(NCCc1ccc(Cl)cc1)c1ccc(Nc2ccc(F)cc2F)cn1.
What is the InChIKey of N-[2-(4-chlorophenyl)ethyl]-5-(2,4-difluoroanilino)pyridine-2-carboxamide?
The InChIKey is DWWFTTISKGBSBN-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H16ClF2N3O/c21-14-3-1-13(2-4-14)9-10-24-20(27)19-8-6-16(12-25-19)26-18-7-5-15(22)11-17(18)23/h1-8,11-12,26H,9-10H2,(H,24,27).
What are the key properties of N-[2-(4-chlorophenyl)ethyl]-5-(2,4-difluoroanilino)pyridine-2-carboxamide?
N-[2-(4-chlorophenyl)ethyl]-5-(2,4-difluoroanilino)pyridine-2-carboxamide has a molecular weight of 387.82 g/mol, XLogP of 4.73, 6 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-[2-(4-chlorophenyl)ethyl]-5-(2,4-difluoroanilino)pyridine-2-carboxamide is sourced from PubChem (CID 109193674), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).