2-(3-fluorophenoxy)-N-[4-(6-methoxypyridazin-3-yl)phenyl]propanamide

C20H18FN3O3 — CID 43991214

IUPAC2-(3-fluorophenoxy)-N-[4-(6-methoxypyridazin-3-yl)phenyl]propanamide
SMILESCOc1ccc(-c2ccc(NC(=O)C(C)Oc3cccc(F)c3)cc2)nn1
InChIInChI=1S/C20H18FN3O3/c1-13(27-17-5-3-4-15(21)12-17)20(25)22-16-8-6-14(7-9-16)18-10-11-19(26-2)24-23-18/h3-13H,1-2H3,(H,22,25)
InChIKeyOQRBOUJXRMAFAC-UHFFFAOYSA-N
MW367.38 g/mol
LogP3.70
Rot. Bonds6

About 2-(3-fluorophenoxy)-N-[4-(6-methoxypyridazin-3-yl)phenyl]propanamide

2-(3-fluorophenoxy)-N-[4-(6-methoxypyridazin-3-yl)phenyl]propanamide (PubChem CID 43991214) has the molecular formula C20H18FN3O3 and a molecular weight of 367.38 g/mol. Its IUPAC name is 2-(3-fluorophenoxy)-N-[4-(6-methoxypyridazin-3-yl)phenyl]propanamide.

Molecular Properties

Compound Name2-(3-fluorophenoxy)-N-[4-(6-methoxypyridazin-3-yl)phenyl]propanamide
PubChem CID43991214
Molecular FormulaC20H18FN3O3
Molecular Weight367.38 g/mol
Exact Mass367.13
IUPAC Name2-(3-fluorophenoxy)-N-[4-(6-methoxypyridazin-3-yl)phenyl]propanamide
SMILESCOc1ccc(-c2ccc(NC(=O)C(C)Oc3cccc(F)c3)cc2)nn1
InChIInChI=1S/C20H18FN3O3/c1-13(27-17-5-3-4-15(21)12-17)20(25)22-16-8-6-14(7-9-16)18-10-11-19(26-2)24-23-18/h3-13H,1-2H3,(H,22,25)
InChIKeyOQRBOUJXRMAFAC-UHFFFAOYSA-N
XLogP3.70
TPSA73.34 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds6
Heavy Atoms27
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500367.38
LogP ≤ 53.70
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Related Compounds

2-(4-methoxyphenoxy)-N-[4-(6-methoxypyridazin-3-yl)phenyl]propanamide
CID 43991201
N-(3,4-dimethoxyphenyl)-2-(3-fluorophenoxy)propanamide
CID 51233943
(2S)-N-(4-acetylphenyl)-2-(3-fluorophenoxy)propanamide
CID 7834470
N-(4-cyanophenyl)-2-(3-fluorophenoxy)propanamide
CID 43176837
methyl N-[3-[2-(3-fluorophenoxy)propanoylamino]phenyl]carbamate
CID 87025785
2-(3-methoxyphenoxy)-N-(4-methoxyphenyl)propanamide
CID 19203873
N-(3-bromophenyl)-2-(3-fluorophenoxy)propanamide
CID 47119298
2-(3-fluorophenoxy)-N-[3-[6-(4-methylpiperazin-1-yl)pyridazin-3-yl]phenyl]propanamide
CID 43992084
N-(5-acetamido-2-methylphenyl)-2-(3-fluorophenoxy)propanamide
CID 86986176
(4-acetamidophenyl) 2-(3-fluorophenoxy)propanoate
CID 47024197
2-(4-acetamidophenoxy)-N-(3-methoxyphenyl)propanamide
CID 4884235
N-(3-fluorophenyl)-2-(4-methylphenoxy)propanamide
CID 18076804

Frequently Asked Questions

What is the IUPAC name of 2-(3-fluorophenoxy)-N-[4-(6-methoxypyridazin-3-yl)phenyl]propanamide?
The IUPAC name of 2-(3-fluorophenoxy)-N-[4-(6-methoxypyridazin-3-yl)phenyl]propanamide (CID 43991214) is 2-(3-fluorophenoxy)-N-[4-(6-methoxypyridazin-3-yl)phenyl]propanamide.
What is the SMILES notation for 2-(3-fluorophenoxy)-N-[4-(6-methoxypyridazin-3-yl)phenyl]propanamide?
The canonical SMILES for 2-(3-fluorophenoxy)-N-[4-(6-methoxypyridazin-3-yl)phenyl]propanamide is COc1ccc(-c2ccc(NC(=O)C(C)Oc3cccc(F)c3)cc2)nn1.
What is the InChIKey of 2-(3-fluorophenoxy)-N-[4-(6-methoxypyridazin-3-yl)phenyl]propanamide?
The InChIKey is OQRBOUJXRMAFAC-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H18FN3O3/c1-13(27-17-5-3-4-15(21)12-17)20(25)22-16-8-6-14(7-9-16)18-10-11-19(26-2)24-23-18/h3-13H,1-2H3,(H,22,25).
What are the key properties of 2-(3-fluorophenoxy)-N-[4-(6-methoxypyridazin-3-yl)phenyl]propanamide?
2-(3-fluorophenoxy)-N-[4-(6-methoxypyridazin-3-yl)phenyl]propanamide has a molecular weight of 367.38 g/mol, XLogP of 3.70, 6 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(3-fluorophenoxy)-N-[4-(6-methoxypyridazin-3-yl)phenyl]propanamide is sourced from PubChem (CID 43991214), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).