5-[6-[4-[2-(2-fluoroanilino)-2-oxoethyl]morpholin-2-yl]-2-pyridinyl]-N-methylpyridine-2-carboxamide

C24H24FN5O3 — CID 127250668

IUPAC5-[6-[4-[2-(2-fluoroanilino)-2-oxoethyl]morpholin-2-yl]-2-pyridinyl]-N-methylpyridine-2-carboxamide
SMILESCNC(=O)c1ccc(-c2cccc(C3CN(CC(=O)Nc4ccccc4F)CCO3)n2)cn1
InChIInChI=1S/C24H24FN5O3/c1-26-24(32)21-10-9-16(13-27-21)18-7-4-8-20(28-18)22-14-30(11-12-33-22)15-23(31)29-19-6-3-2-5-17(19)25/h2-10,13,22H,11-12,14-15H2,1H3,(H,26,32)(H,29,31)
InChIKeySNTKCIBIRCDVOK-UHFFFAOYSA-N
MW449.49 g/mol
LogP2.65
Rot. Bonds6

About 5-[6-[4-[2-(2-fluoroanilino)-2-oxoethyl]morpholin-2-yl]-2-pyridinyl]-N-methylpyridine-2-carboxamide

5-[6-[4-[2-(2-fluoroanilino)-2-oxoethyl]morpholin-2-yl]-2-pyridinyl]-N-methylpyridine-2-carboxamide (PubChem CID 127250668) has the molecular formula C24H24FN5O3 and a molecular weight of 449.49 g/mol. Its IUPAC name is 5-[6-[4-[2-(2-fluoroanilino)-2-oxoethyl]morpholin-2-yl]-2-pyridinyl]-N-methylpyridine-2-carboxamide.

Molecular Properties

Compound Name5-[6-[4-[2-(2-fluoroanilino)-2-oxoethyl]morpholin-2-yl]-2-pyridinyl]-N-methylpyridine-2-carboxamide
PubChem CID127250668
Molecular FormulaC24H24FN5O3
Molecular Weight449.49 g/mol
Exact Mass449.19
IUPAC Name5-[6-[4-[2-(2-fluoroanilino)-2-oxoethyl]morpholin-2-yl]-2-pyridinyl]-N-methylpyridine-2-carboxamide
SMILESCNC(=O)c1ccc(-c2cccc(C3CN(CC(=O)Nc4ccccc4F)CCO3)n2)cn1
InChIInChI=1S/C24H24FN5O3/c1-26-24(32)21-10-9-16(13-27-21)18-7-4-8-20(28-18)22-14-30(11-12-33-22)15-23(31)29-19-6-3-2-5-17(19)25/h2-10,13,22H,11-12,14-15H2,1H3,(H,26,32)(H,29,31)
InChIKeySNTKCIBIRCDVOK-UHFFFAOYSA-N
XLogP2.65
TPSA96.45 Ų
H-Bond Donors2
H-Bond Acceptors6
Rotatable Bonds6
Heavy Atoms33
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500449.49
LogP ≤ 52.65
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 106

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Related Compounds

N-(2-fluorophenyl)-2-[2-[5-[(2-fluorophenyl)methyl]-2-pyridinyl]morpholin-4-yl]acetamide
CID 127250139
2-[2-[4-(2-aminopyrimidin-5-yl)-6-methyl-2-pyridinyl]morpholin-4-yl]-N-(2-fluorophenyl)acetamide
CID 127251352
5-[6-[(2R)-4-(4,6-dimethylpyrimidin-2-yl)morpholin-2-yl]-2-pyridinyl]-N-methylpyridine-2-carboxamide
CID 125013491
5-[6-[(2R)-4-[4-(methoxymethyl)benzoyl]morpholin-2-yl]-2-pyridinyl]-N-methylpyridine-2-carboxamide
CID 124973780
N-(2-fluorophenyl)-2-[3-(methylamino)piperidin-1-yl]acetamide;hydrochloride
CID 119919928
2-[2-(4,4-difluoropiperidine-1-carbonyl)morpholin-4-yl]-N-(2-fluorophenyl)acetamide
CID 163352384
N-(2-fluorophenyl)-3-[2-(4-fluorophenyl)morpholin-4-yl]propanamide
CID 43065711
N-(2-fluorophenyl)-3-[(2R)-2-(4-fluorophenyl)morpholin-4-yl]propanamide
CID 30891589
N-(2-fluorophenyl)-2-[4-(methylamino)piperidin-1-yl]acetamide
CID 54923773
2-[2-(4-chlorophenyl)morpholin-4-yl]-N-(3-fluorophenyl)acetamide
CID 60504856
4-[6-[(2R)-4-[2-(diethylamino)-2-oxoethyl]morpholin-2-yl]-2-pyridinyl]benzamide
CID 125019777
4-[6-[(2S)-4-[(4-fluorophenyl)methyl]morpholin-2-yl]-2-pyridinyl]benzamide
CID 124963234

Frequently Asked Questions

What is the IUPAC name of 5-[6-[4-[2-(2-fluoroanilino)-2-oxoethyl]morpholin-2-yl]-2-pyridinyl]-N-methylpyridine-2-carboxamide?
The IUPAC name of 5-[6-[4-[2-(2-fluoroanilino)-2-oxoethyl]morpholin-2-yl]-2-pyridinyl]-N-methylpyridine-2-carboxamide (CID 127250668) is 5-[6-[4-[2-(2-fluoroanilino)-2-oxoethyl]morpholin-2-yl]-2-pyridinyl]-N-methylpyridine-2-carboxamide.
What is the SMILES notation for 5-[6-[4-[2-(2-fluoroanilino)-2-oxoethyl]morpholin-2-yl]-2-pyridinyl]-N-methylpyridine-2-carboxamide?
The canonical SMILES for 5-[6-[4-[2-(2-fluoroanilino)-2-oxoethyl]morpholin-2-yl]-2-pyridinyl]-N-methylpyridine-2-carboxamide is CNC(=O)c1ccc(-c2cccc(C3CN(CC(=O)Nc4ccccc4F)CCO3)n2)cn1.
What is the InChIKey of 5-[6-[4-[2-(2-fluoroanilino)-2-oxoethyl]morpholin-2-yl]-2-pyridinyl]-N-methylpyridine-2-carboxamide?
The InChIKey is SNTKCIBIRCDVOK-UHFFFAOYSA-N. The full InChI is InChI=1S/C24H24FN5O3/c1-26-24(32)21-10-9-16(13-27-21)18-7-4-8-20(28-18)22-14-30(11-12-33-22)15-23(31)29-19-6-3-2-5-17(19)25/h2-10,13,22H,11-12,14-15H2,1H3,(H,26,32)(H,29,31).
What are the key properties of 5-[6-[4-[2-(2-fluoroanilino)-2-oxoethyl]morpholin-2-yl]-2-pyridinyl]-N-methylpyridine-2-carboxamide?
5-[6-[4-[2-(2-fluoroanilino)-2-oxoethyl]morpholin-2-yl]-2-pyridinyl]-N-methylpyridine-2-carboxamide has a molecular weight of 449.49 g/mol, XLogP of 2.65, 6 rotatable bonds, 2 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 5-[6-[4-[2-(2-fluoroanilino)-2-oxoethyl]morpholin-2-yl]-2-pyridinyl]-N-methylpyridine-2-carboxamide is sourced from PubChem (CID 127250668), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).