6-[4-(4-fluorophenoxy)phenyl]-4-(methanesulfonamidomethyl)pyridine-2-carboxamide

C20H18FN3O4S — CID 56943487

IUPAC6-[4-(4-fluorophenoxy)phenyl]-4-(methanesulfonamidomethyl)pyridine-2-carboxamide
SMILESCS(=O)(=O)NCc1cc(C(N)=O)nc(-c2ccc(Oc3ccc(F)cc3)cc2)c1
InChIInChI=1S/C20H18FN3O4S/c1-29(26,27)23-12-13-10-18(24-19(11-13)20(22)25)14-2-6-16(7-3-14)28-17-8-4-15(21)5-9-17/h2-11,23H,12H2,1H3,(H2,22,25)
InChIKeySBCWNDSDSOCXBS-UHFFFAOYSA-N
MW415.45 g/mol
LogP2.83
Rot. Bonds7

About 6-[4-(4-fluorophenoxy)phenyl]-4-(methanesulfonamidomethyl)pyridine-2-carboxamide

6-[4-(4-fluorophenoxy)phenyl]-4-(methanesulfonamidomethyl)pyridine-2-carboxamide (PubChem CID 56943487) has the molecular formula C20H18FN3O4S and a molecular weight of 415.45 g/mol. Its IUPAC name is 6-[4-(4-fluorophenoxy)phenyl]-4-(methanesulfonamidomethyl)pyridine-2-carboxamide.

Molecular Properties

Compound Name6-[4-(4-fluorophenoxy)phenyl]-4-(methanesulfonamidomethyl)pyridine-2-carboxamide
PubChem CID56943487
Molecular FormulaC20H18FN3O4S
Molecular Weight415.45 g/mol
Exact Mass415.10
IUPAC Name6-[4-(4-fluorophenoxy)phenyl]-4-(methanesulfonamidomethyl)pyridine-2-carboxamide
SMILESCS(=O)(=O)NCc1cc(C(N)=O)nc(-c2ccc(Oc3ccc(F)cc3)cc2)c1
InChIInChI=1S/C20H18FN3O4S/c1-29(26,27)23-12-13-10-18(24-19(11-13)20(22)25)14-2-6-16(7-3-14)28-17-8-4-15(21)5-9-17/h2-11,23H,12H2,1H3,(H2,22,25)
InChIKeySBCWNDSDSOCXBS-UHFFFAOYSA-N
XLogP2.83
TPSA111.38 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds7
Heavy Atoms29
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500415.45
LogP ≤ 52.83
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

Analyze 6-[4-(4-fluorophenoxy)phenyl]-4-(methanesulfonamidomethyl)pyridine-2-carboxamide with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

6-(4-(2-(Benzylamino)ethyl)phenoxy)picolinamide
CID 44434931
2-[3-fluoro-4-(methanesulfonamido)phenyl]-N-[[2-(4-methoxyphenyl)-6-(trifluoromethyl)pyridin-3-yl]methyl]propanamide
CID 58873763
Pyridine amide, 29
CID 44237004
6-[4-(4-Fluorophenoxy)phenyl]pyridine-2-carboxamide
CID 9836230
6-[4-(4-Fluorophenoxy)phenyl]-4-morpholin-4-ylpyridine-2-carboxamide
CID 10340527
6-[4-(4-Fluorophenoxy)phenyl]-4-methoxypyridine-2-carboxamide
CID 11221428
6-[4-(4-Fluorophenoxy)phenyl]-N-[2-(1-piperidinyl)ethyl]-2-pyridinecarboxamide
CID 11247128
N-[2-(dimethylamino)ethyl]-6-[4-(4-fluorophenoxy)phenyl]-4-methoxypyridine-2-carboxamide
CID 11475352
2-[3-fluoro-4-(methanesulfonamido)phenyl]-N-[[2-(4-methylphenoxy)-6-(trifluoromethyl)pyridin-3-yl]methyl]propanamide
CID 58873778
2-[3-fluoro-4-(methanesulfonamido)phenyl]-N-[[2-(3-fluoro-4-methoxyphenyl)-6-(trifluoromethyl)pyridin-3-yl]methyl]propanamide
CID 67440200
2-[4-(4-fluorophenoxy)phenyl]-6-methyl-N-[2-(1-methylpiperidin-1-ium-1-yl)ethyl]pyridine-4-carboxamide
CID 71566103
US10335399, Example 2-5
CID 134363739

Frequently Asked Questions

What is the IUPAC name of 6-[4-(4-fluorophenoxy)phenyl]-4-(methanesulfonamidomethyl)pyridine-2-carboxamide?
The IUPAC name of 6-[4-(4-fluorophenoxy)phenyl]-4-(methanesulfonamidomethyl)pyridine-2-carboxamide (CID 56943487) is 6-[4-(4-fluorophenoxy)phenyl]-4-(methanesulfonamidomethyl)pyridine-2-carboxamide.
What is the SMILES notation for 6-[4-(4-fluorophenoxy)phenyl]-4-(methanesulfonamidomethyl)pyridine-2-carboxamide?
The canonical SMILES for 6-[4-(4-fluorophenoxy)phenyl]-4-(methanesulfonamidomethyl)pyridine-2-carboxamide is CS(=O)(=O)NCc1cc(C(N)=O)nc(-c2ccc(Oc3ccc(F)cc3)cc2)c1.
What is the InChIKey of 6-[4-(4-fluorophenoxy)phenyl]-4-(methanesulfonamidomethyl)pyridine-2-carboxamide?
The InChIKey is SBCWNDSDSOCXBS-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H18FN3O4S/c1-29(26,27)23-12-13-10-18(24-19(11-13)20(22)25)14-2-6-16(7-3-14)28-17-8-4-15(21)5-9-17/h2-11,23H,12H2,1H3,(H2,22,25).
What are the key properties of 6-[4-(4-fluorophenoxy)phenyl]-4-(methanesulfonamidomethyl)pyridine-2-carboxamide?
6-[4-(4-fluorophenoxy)phenyl]-4-(methanesulfonamidomethyl)pyridine-2-carboxamide has a molecular weight of 415.45 g/mol, XLogP of 2.83, 7 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 6-[4-(4-fluorophenoxy)phenyl]-4-(methanesulfonamidomethyl)pyridine-2-carboxamide is sourced from PubChem (CID 56943487), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).