N-(3-fluorophenyl)-5-[2-(2-methoxyphenyl)ethylamino]pyridine-2-carboxamide

C21H20FN3O2 — CID 109192588

IUPACN-(3-fluorophenyl)-5-[2-(2-methoxyphenyl)ethylamino]pyridine-2-carboxamide
SMILESCOc1ccccc1CCNc1ccc(C(=O)Nc2cccc(F)c2)nc1
InChIInChI=1S/C21H20FN3O2/c1-27-20-8-3-2-5-15(20)11-12-23-18-9-10-19(24-14-18)21(26)25-17-7-4-6-16(22)13-17/h2-10,13-14,23H,11-12H2,1H3,(H,25,26)
InChIKeyZSDCMOZORMUYDV-UHFFFAOYSA-N
MW365.41 g/mol
LogP4.14
Rot. Bonds7

About N-(3-fluorophenyl)-5-[2-(2-methoxyphenyl)ethylamino]pyridine-2-carboxamide

N-(3-fluorophenyl)-5-[2-(2-methoxyphenyl)ethylamino]pyridine-2-carboxamide (PubChem CID 109192588) has the molecular formula C21H20FN3O2 and a molecular weight of 365.41 g/mol. Its IUPAC name is N-(3-fluorophenyl)-5-[2-(2-methoxyphenyl)ethylamino]pyridine-2-carboxamide.

Molecular Properties

Compound NameN-(3-fluorophenyl)-5-[2-(2-methoxyphenyl)ethylamino]pyridine-2-carboxamide
PubChem CID109192588
Molecular FormulaC21H20FN3O2
Molecular Weight365.41 g/mol
Exact Mass365.15
IUPAC NameN-(3-fluorophenyl)-5-[2-(2-methoxyphenyl)ethylamino]pyridine-2-carboxamide
SMILESCOc1ccccc1CCNc1ccc(C(=O)Nc2cccc(F)c2)nc1
InChIInChI=1S/C21H20FN3O2/c1-27-20-8-3-2-5-15(20)11-12-23-18-9-10-19(24-14-18)21(26)25-17-7-4-6-16(22)13-17/h2-10,13-14,23H,11-12H2,1H3,(H,25,26)
InChIKeyZSDCMOZORMUYDV-UHFFFAOYSA-N
XLogP4.14
TPSA63.25 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds7
Heavy Atoms27
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500365.41
LogP ≤ 54.14
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of N-(3-fluorophenyl)-5-[2-(2-methoxyphenyl)ethylamino]pyridine-2-carboxamide?
The IUPAC name of N-(3-fluorophenyl)-5-[2-(2-methoxyphenyl)ethylamino]pyridine-2-carboxamide (CID 109192588) is N-(3-fluorophenyl)-5-[2-(2-methoxyphenyl)ethylamino]pyridine-2-carboxamide.
What is the SMILES notation for N-(3-fluorophenyl)-5-[2-(2-methoxyphenyl)ethylamino]pyridine-2-carboxamide?
The canonical SMILES for N-(3-fluorophenyl)-5-[2-(2-methoxyphenyl)ethylamino]pyridine-2-carboxamide is COc1ccccc1CCNc1ccc(C(=O)Nc2cccc(F)c2)nc1.
What is the InChIKey of N-(3-fluorophenyl)-5-[2-(2-methoxyphenyl)ethylamino]pyridine-2-carboxamide?
The InChIKey is ZSDCMOZORMUYDV-UHFFFAOYSA-N. The full InChI is InChI=1S/C21H20FN3O2/c1-27-20-8-3-2-5-15(20)11-12-23-18-9-10-19(24-14-18)21(26)25-17-7-4-6-16(22)13-17/h2-10,13-14,23H,11-12H2,1H3,(H,25,26).
What are the key properties of N-(3-fluorophenyl)-5-[2-(2-methoxyphenyl)ethylamino]pyridine-2-carboxamide?
N-(3-fluorophenyl)-5-[2-(2-methoxyphenyl)ethylamino]pyridine-2-carboxamide has a molecular weight of 365.41 g/mol, XLogP of 4.14, 7 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-(3-fluorophenyl)-5-[2-(2-methoxyphenyl)ethylamino]pyridine-2-carboxamide is sourced from PubChem (CID 109192588), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).