2-(3-fluorophenyl)-N-[5-(N-methylanilino)-2-pyridinyl]acetamide

C20H18FN3O — CID 113031689

IUPAC2-(3-fluorophenyl)-N-[5-(N-methylanilino)-2-pyridinyl]acetamide
SMILESCN(c1ccccc1)c1ccc(NC(=O)Cc2cccc(F)c2)nc1
InChIInChI=1S/C20H18FN3O/c1-24(17-8-3-2-4-9-17)18-10-11-19(22-14-18)23-20(25)13-15-6-5-7-16(21)12-15/h2-12,14H,13H2,1H3,(H,22,23,25)
InChIKeyFDISAKASKOGIDP-UHFFFAOYSA-N
MW335.38 g/mol
LogP4.17
Rot. Bonds5

About 2-(3-fluorophenyl)-N-[5-(N-methylanilino)-2-pyridinyl]acetamide

2-(3-fluorophenyl)-N-[5-(N-methylanilino)-2-pyridinyl]acetamide (PubChem CID 113031689) has the molecular formula C20H18FN3O and a molecular weight of 335.38 g/mol. Its IUPAC name is 2-(3-fluorophenyl)-N-[5-(N-methylanilino)-2-pyridinyl]acetamide.

Molecular Properties

Compound Name2-(3-fluorophenyl)-N-[5-(N-methylanilino)-2-pyridinyl]acetamide
PubChem CID113031689
Molecular FormulaC20H18FN3O
Molecular Weight335.38 g/mol
Exact Mass335.14
IUPAC Name2-(3-fluorophenyl)-N-[5-(N-methylanilino)-2-pyridinyl]acetamide
SMILESCN(c1ccccc1)c1ccc(NC(=O)Cc2cccc(F)c2)nc1
InChIInChI=1S/C20H18FN3O/c1-24(17-8-3-2-4-9-17)18-10-11-19(22-14-18)23-20(25)13-15-6-5-7-16(21)12-15/h2-12,14H,13H2,1H3,(H,22,23,25)
InChIKeyFDISAKASKOGIDP-UHFFFAOYSA-N
XLogP4.17
TPSA45.23 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms25
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500335.38
LogP ≤ 54.17
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 2-(3-fluorophenyl)-N-[5-(N-methylanilino)-2-pyridinyl]acetamide?
The IUPAC name of 2-(3-fluorophenyl)-N-[5-(N-methylanilino)-2-pyridinyl]acetamide (CID 113031689) is 2-(3-fluorophenyl)-N-[5-(N-methylanilino)-2-pyridinyl]acetamide.
What is the SMILES notation for 2-(3-fluorophenyl)-N-[5-(N-methylanilino)-2-pyridinyl]acetamide?
The canonical SMILES for 2-(3-fluorophenyl)-N-[5-(N-methylanilino)-2-pyridinyl]acetamide is CN(c1ccccc1)c1ccc(NC(=O)Cc2cccc(F)c2)nc1.
What is the InChIKey of 2-(3-fluorophenyl)-N-[5-(N-methylanilino)-2-pyridinyl]acetamide?
The InChIKey is FDISAKASKOGIDP-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H18FN3O/c1-24(17-8-3-2-4-9-17)18-10-11-19(22-14-18)23-20(25)13-15-6-5-7-16(21)12-15/h2-12,14H,13H2,1H3,(H,22,23,25).
What are the key properties of 2-(3-fluorophenyl)-N-[5-(N-methylanilino)-2-pyridinyl]acetamide?
2-(3-fluorophenyl)-N-[5-(N-methylanilino)-2-pyridinyl]acetamide has a molecular weight of 335.38 g/mol, XLogP of 4.17, 5 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(3-fluorophenyl)-N-[5-(N-methylanilino)-2-pyridinyl]acetamide is sourced from PubChem (CID 113031689), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).