2-(2-fluorophenoxy)-N-[4-[(5-morpholin-4-ylpyridazin-3-yl)amino]phenyl]propanamide

C23H24FN5O3 — CID 122355185

IUPAC2-(2-fluorophenoxy)-N-[4-[(5-morpholin-4-ylpyridazin-3-yl)amino]phenyl]propanamide
SMILESCC(Oc1ccccc1F)C(=O)Nc1ccc(Nc2cc(N3CCOCC3)cnn2)cc1
InChIInChI=1S/C23H24FN5O3/c1-16(32-21-5-3-2-4-20(21)24)23(30)27-18-8-6-17(7-9-18)26-22-14-19(15-25-28-22)29-10-12-31-13-11-29/h2-9,14-16H,10-13H2,1H3,(H,26,28)(H,27,30)
InChIKeyLYACMSHPARMOIQ-UHFFFAOYSA-N
MW437.48 g/mol
LogP3.60
Rot. Bonds7

About 2-(2-fluorophenoxy)-N-[4-[(5-morpholin-4-ylpyridazin-3-yl)amino]phenyl]propanamide

2-(2-fluorophenoxy)-N-[4-[(5-morpholin-4-ylpyridazin-3-yl)amino]phenyl]propanamide (PubChem CID 122355185) has the molecular formula C23H24FN5O3 and a molecular weight of 437.48 g/mol. Its IUPAC name is 2-(2-fluorophenoxy)-N-[4-[(5-morpholin-4-ylpyridazin-3-yl)amino]phenyl]propanamide.

Molecular Properties

Compound Name2-(2-fluorophenoxy)-N-[4-[(5-morpholin-4-ylpyridazin-3-yl)amino]phenyl]propanamide
PubChem CID122355185
Molecular FormulaC23H24FN5O3
Molecular Weight437.48 g/mol
Exact Mass437.19
IUPAC Name2-(2-fluorophenoxy)-N-[4-[(5-morpholin-4-ylpyridazin-3-yl)amino]phenyl]propanamide
SMILESCC(Oc1ccccc1F)C(=O)Nc1ccc(Nc2cc(N3CCOCC3)cnn2)cc1
InChIInChI=1S/C23H24FN5O3/c1-16(32-21-5-3-2-4-20(21)24)23(30)27-18-8-6-17(7-9-18)26-22-14-19(15-25-28-22)29-10-12-31-13-11-29/h2-9,14-16H,10-13H2,1H3,(H,26,28)(H,27,30)
InChIKeyLYACMSHPARMOIQ-UHFFFAOYSA-N
XLogP3.60
TPSA88.61 Ų
H-Bond Donors2
H-Bond Acceptors7
Rotatable Bonds7
Heavy Atoms32
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500437.48
LogP ≤ 53.60
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 107

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Related Compounds

2-(2-fluorophenoxy)-N-(3-(6-morpholinopyridazin-3-yl)phenyl)propanamide
CID 43991948
2-(3-fluorophenoxy)-N-(3-(6-morpholinopyridazin-3-yl)phenyl)propanamide
CID 43991949
2-(3-Fluorophenoxy)-1-[4-[(6-methylpyridazin-3-yl)amino]piperidin-1-yl]ethanone
CID 53621221
N-(4-((6-methylpyridazin-3-yl)amino)phenyl)-2-phenoxyacetamide
CID 45502517
2-(4-fluorophenoxy)-N-[6-(4-methylpiperazin-1-yl)-3-pyridinyl]propanamide
CID 24240138
2-(2-fluorophenoxy)-N-pyridazin-3-ylbutanamide
CID 71863410
3-(4-Fluorophenoxy)-1-methyl-8-morpholin-4-ylpyrido[2,3-d]pyridazin-2-one
CID 58514583
1-[3-(1-Acetylpiperidin-3-yl)oxy-5-fluorophenyl]-3-pyridazin-4-ylurea
CID 68982907
1-[3-(1-Acetylpiperidin-3-yl)oxy-5-fluorophenyl]-3-pyridazin-3-ylurea
CID 68984424
1-[3-(1-Acetylpiperidin-3-yl)oxy-5-fluorophenyl]-1-pyridazin-3-ylurea
CID 69657543
2-Phenoxy-1-(4-(6-(pyridin-4-ylamino)pyridazin-3-yl)piperazin-1-yl)ethanone
CID 42111980
2-(3-fluorophenoxy)-N-(1-phenylpyrazol-3-yl)acetamide
CID 24248341

Frequently Asked Questions

What is the IUPAC name of 2-(2-fluorophenoxy)-N-[4-[(5-morpholin-4-ylpyridazin-3-yl)amino]phenyl]propanamide?
The IUPAC name of 2-(2-fluorophenoxy)-N-[4-[(5-morpholin-4-ylpyridazin-3-yl)amino]phenyl]propanamide (CID 122355185) is 2-(2-fluorophenoxy)-N-[4-[(5-morpholin-4-ylpyridazin-3-yl)amino]phenyl]propanamide.
What is the SMILES notation for 2-(2-fluorophenoxy)-N-[4-[(5-morpholin-4-ylpyridazin-3-yl)amino]phenyl]propanamide?
The canonical SMILES for 2-(2-fluorophenoxy)-N-[4-[(5-morpholin-4-ylpyridazin-3-yl)amino]phenyl]propanamide is CC(Oc1ccccc1F)C(=O)Nc1ccc(Nc2cc(N3CCOCC3)cnn2)cc1.
What is the InChIKey of 2-(2-fluorophenoxy)-N-[4-[(5-morpholin-4-ylpyridazin-3-yl)amino]phenyl]propanamide?
The InChIKey is LYACMSHPARMOIQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C23H24FN5O3/c1-16(32-21-5-3-2-4-20(21)24)23(30)27-18-8-6-17(7-9-18)26-22-14-19(15-25-28-22)29-10-12-31-13-11-29/h2-9,14-16H,10-13H2,1H3,(H,26,28)(H,27,30).
What are the key properties of 2-(2-fluorophenoxy)-N-[4-[(5-morpholin-4-ylpyridazin-3-yl)amino]phenyl]propanamide?
2-(2-fluorophenoxy)-N-[4-[(5-morpholin-4-ylpyridazin-3-yl)amino]phenyl]propanamide has a molecular weight of 437.48 g/mol, XLogP of 3.60, 7 rotatable bonds, 2 hydrogen bond donors, and 7 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(2-fluorophenoxy)-N-[4-[(5-morpholin-4-ylpyridazin-3-yl)amino]phenyl]propanamide is sourced from PubChem (CID 122355185), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).