2-(2-fluorophenyl)-N-[6-[(4-methoxyphenyl)methylamino]pyridazin-3-yl]acetamide

C20H19FN4O2 — CID 113041787

IUPAC2-(2-fluorophenyl)-N-[6-[(4-methoxyphenyl)methylamino]pyridazin-3-yl]acetamide
SMILESCOc1ccc(CNc2ccc(NC(=O)Cc3ccccc3F)nn2)cc1
InChIInChI=1S/C20H19FN4O2/c1-27-16-8-6-14(7-9-16)13-22-18-10-11-19(25-24-18)23-20(26)12-15-4-2-3-5-17(15)21/h2-11H,12-13H2,1H3,(H,22,24)(H,23,25,26)
InChIKeyBLBHFGWTKNEIQV-UHFFFAOYSA-N
MW366.40 g/mol
LogP3.42
Rot. Bonds7

About 2-(2-fluorophenyl)-N-[6-[(4-methoxyphenyl)methylamino]pyridazin-3-yl]acetamide

2-(2-fluorophenyl)-N-[6-[(4-methoxyphenyl)methylamino]pyridazin-3-yl]acetamide (PubChem CID 113041787) has the molecular formula C20H19FN4O2 and a molecular weight of 366.40 g/mol. Its IUPAC name is 2-(2-fluorophenyl)-N-[6-[(4-methoxyphenyl)methylamino]pyridazin-3-yl]acetamide.

Molecular Properties

Compound Name2-(2-fluorophenyl)-N-[6-[(4-methoxyphenyl)methylamino]pyridazin-3-yl]acetamide
PubChem CID113041787
Molecular FormulaC20H19FN4O2
Molecular Weight366.40 g/mol
Exact Mass366.15
IUPAC Name2-(2-fluorophenyl)-N-[6-[(4-methoxyphenyl)methylamino]pyridazin-3-yl]acetamide
SMILESCOc1ccc(CNc2ccc(NC(=O)Cc3ccccc3F)nn2)cc1
InChIInChI=1S/C20H19FN4O2/c1-27-16-8-6-14(7-9-16)13-22-18-10-11-19(25-24-18)23-20(26)12-15-4-2-3-5-17(15)21/h2-11H,12-13H2,1H3,(H,22,24)(H,23,25,26)
InChIKeyBLBHFGWTKNEIQV-UHFFFAOYSA-N
XLogP3.42
TPSA76.14 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds7
Heavy Atoms27
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500366.40
LogP ≤ 53.42
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

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Related Compounds

2-(4-methoxyphenyl)-N-[6-[(2-methylphenyl)methylamino]pyridazin-3-yl]acetamide
CID 113040895
N-[6-[(4-methoxyphenyl)methylamino]pyridazin-3-yl]benzamide
CID 113041752
2-(2-fluorophenyl)-N-[6-(2-methoxyethylamino)pyridazin-3-yl]acetamide
CID 113039450
N-[5-[(2-fluorophenyl)methylamino]-2-pyridinyl]-2-(4-methoxyphenyl)acetamide
CID 113027011
4-methoxy-N-[6-[(4-methoxyphenyl)methylamino]pyridazin-3-yl]benzamide
CID 113041761
N-[6-(1,3-benzodioxol-5-ylmethylamino)pyridazin-3-yl]-2-(2-fluorophenyl)acetamide
CID 113041856
N-[6-(furan-2-ylmethylamino)pyridazin-3-yl]-2-(4-methoxyphenyl)acetamide
CID 113040667
N-[6-[(4-methoxyphenyl)methylamino]pyridazin-3-yl]cyclopropanecarboxamide
CID 113041743
2-(2-fluorophenyl)-N-[2-[(4-methoxyphenyl)methylamino]-2-oxoethyl]acetamide
CID 48502002
N-[6-[2-(2-fluorophenyl)ethylamino]pyridazin-3-yl]-2-(4-methylphenyl)acetamide
CID 113042536
2-(4-methoxyphenyl)-N-[6-(propylamino)pyridazin-3-yl]acetamide
CID 113037821
6-[[4-[(2-fluorophenyl)methoxy]phenyl]methylamino]pyridazine-3-carboxamide
CID 133477298

Frequently Asked Questions

What is the IUPAC name of 2-(2-fluorophenyl)-N-[6-[(4-methoxyphenyl)methylamino]pyridazin-3-yl]acetamide?
The IUPAC name of 2-(2-fluorophenyl)-N-[6-[(4-methoxyphenyl)methylamino]pyridazin-3-yl]acetamide (CID 113041787) is 2-(2-fluorophenyl)-N-[6-[(4-methoxyphenyl)methylamino]pyridazin-3-yl]acetamide.
What is the SMILES notation for 2-(2-fluorophenyl)-N-[6-[(4-methoxyphenyl)methylamino]pyridazin-3-yl]acetamide?
The canonical SMILES for 2-(2-fluorophenyl)-N-[6-[(4-methoxyphenyl)methylamino]pyridazin-3-yl]acetamide is COc1ccc(CNc2ccc(NC(=O)Cc3ccccc3F)nn2)cc1.
What is the InChIKey of 2-(2-fluorophenyl)-N-[6-[(4-methoxyphenyl)methylamino]pyridazin-3-yl]acetamide?
The InChIKey is BLBHFGWTKNEIQV-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H19FN4O2/c1-27-16-8-6-14(7-9-16)13-22-18-10-11-19(25-24-18)23-20(26)12-15-4-2-3-5-17(15)21/h2-11H,12-13H2,1H3,(H,22,24)(H,23,25,26).
What are the key properties of 2-(2-fluorophenyl)-N-[6-[(4-methoxyphenyl)methylamino]pyridazin-3-yl]acetamide?
2-(2-fluorophenyl)-N-[6-[(4-methoxyphenyl)methylamino]pyridazin-3-yl]acetamide has a molecular weight of 366.40 g/mol, XLogP of 3.42, 7 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(2-fluorophenyl)-N-[6-[(4-methoxyphenyl)methylamino]pyridazin-3-yl]acetamide is sourced from PubChem (CID 113041787), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).