2-phenylmethoxy-N-pyridazin-4-yl-5-(trifluoromethyl)benzamide

C19H14F3N3O2 — CID 155553934

IUPAC2-phenylmethoxy-N-pyridazin-4-yl-5-(trifluoromethyl)benzamide
SMILESO=C(Nc1ccnnc1)c1cc(C(F)(F)F)ccc1OCc1ccccc1
InChIInChI=1S/C19H14F3N3O2/c20-19(21,22)14-6-7-17(27-12-13-4-2-1-3-5-13)16(10-14)18(26)25-15-8-9-23-24-11-15/h1-11H,12H2,(H,23,25,26)
InChIKeyPZGKGIIHFIMCQQ-UHFFFAOYSA-N
MW373.33 g/mol
LogP4.33
Rot. Bonds5

About 2-phenylmethoxy-N-pyridazin-4-yl-5-(trifluoromethyl)benzamide

2-phenylmethoxy-N-pyridazin-4-yl-5-(trifluoromethyl)benzamide (PubChem CID 155553934) has the molecular formula C19H14F3N3O2 and a molecular weight of 373.33 g/mol. Its IUPAC name is 2-phenylmethoxy-N-pyridazin-4-yl-5-(trifluoromethyl)benzamide.

Molecular Properties

Compound Name2-phenylmethoxy-N-pyridazin-4-yl-5-(trifluoromethyl)benzamide
PubChem CID155553934
Molecular FormulaC19H14F3N3O2
Molecular Weight373.33 g/mol
Exact Mass373.10
IUPAC Name2-phenylmethoxy-N-pyridazin-4-yl-5-(trifluoromethyl)benzamide
SMILESO=C(Nc1ccnnc1)c1cc(C(F)(F)F)ccc1OCc1ccccc1
InChIInChI=1S/C19H14F3N3O2/c20-19(21,22)14-6-7-17(27-12-13-4-2-1-3-5-13)16(10-14)18(26)25-15-8-9-23-24-11-15/h1-11H,12H2,(H,23,25,26)
InChIKeyPZGKGIIHFIMCQQ-UHFFFAOYSA-N
XLogP4.33
TPSA64.11 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms27
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500373.33
LogP ≤ 54.33
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

Analyze 2-phenylmethoxy-N-pyridazin-4-yl-5-(trifluoromethyl)benzamide 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

N-{4-[2-(4-Acetylpiperazin-1-yl)ethoxy]-3-(1-methyl-1H-pyrazol-5-yl)phenyl}-3-(trifluoromethyl)benzamide
CID 46833371
5-Bromo-2-[(phenylmethyl)oxy]-N-4-pyridazinylbenzamide
CID 51357233
2-{[(4-Fluorophenyl)methyl]oxy}-N-3-pyridinyl-5-(trifluoromethyl)benzamide
CID 67106997
5-(1-Methyl-1H-pyrazol-5-yl)-2-[(phenyl methyl)oxy]-N-3-pyridinylbenzamide
CID 67107000
5-Methyl-2-[(phenylmethyl)oxy]-N-3-pyridinylbenzamide
CID 67107177
2-{[(4-Fluorophenyl)methyl]oxy}-5-(1-methyl-1H-pyrazol-4-yl)-N-3-pyridinylbenzamide
CID 67107333
2-[(4-fluorophenyl)methoxy]-5-(1H-pyrazol-4-yl)-N-pyridin-3-ylbenzamide
CID 67108013
5-Fluoro-2-[(phenylmethyl)oxy]-N-3-pyridinylbenzamide
CID 68107702
5-(1-methylpyrazol-4-yl)-2-phenylmethoxy-N-pyridin-3-ylbenzamide
CID 69937003
5-(1-Methylpyrazol-4-yl)-2-[1-[2-[4-(trifluoromethoxy)phenyl]acetyl]piperidin-4-yl]oxybenzamide
CID 132041675
4-[2-carbamoyl-4-(1-methylpyrazol-4-yl)phenoxy]-N-[4-(trifluoromethoxy)phenyl]piperidine-1-carboxamide
CID 145970062
5-(4-methylpiperazin-1-yl)-2-phenylmethoxy-N-pyridazin-4-ylbenzamide
CID 155511660

Frequently Asked Questions

What is the IUPAC name of 2-phenylmethoxy-N-pyridazin-4-yl-5-(trifluoromethyl)benzamide?
The IUPAC name of 2-phenylmethoxy-N-pyridazin-4-yl-5-(trifluoromethyl)benzamide (CID 155553934) is 2-phenylmethoxy-N-pyridazin-4-yl-5-(trifluoromethyl)benzamide.
What is the SMILES notation for 2-phenylmethoxy-N-pyridazin-4-yl-5-(trifluoromethyl)benzamide?
The canonical SMILES for 2-phenylmethoxy-N-pyridazin-4-yl-5-(trifluoromethyl)benzamide is O=C(Nc1ccnnc1)c1cc(C(F)(F)F)ccc1OCc1ccccc1.
What is the InChIKey of 2-phenylmethoxy-N-pyridazin-4-yl-5-(trifluoromethyl)benzamide?
The InChIKey is PZGKGIIHFIMCQQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H14F3N3O2/c20-19(21,22)14-6-7-17(27-12-13-4-2-1-3-5-13)16(10-14)18(26)25-15-8-9-23-24-11-15/h1-11H,12H2,(H,23,25,26).
What are the key properties of 2-phenylmethoxy-N-pyridazin-4-yl-5-(trifluoromethyl)benzamide?
2-phenylmethoxy-N-pyridazin-4-yl-5-(trifluoromethyl)benzamide has a molecular weight of 373.33 g/mol, XLogP of 4.33, 5 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-phenylmethoxy-N-pyridazin-4-yl-5-(trifluoromethyl)benzamide is sourced from PubChem (CID 155553934), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).