N-(2-chlorophenyl)-4-(6-methoxypyridazin-3-yl)benzamide

C18H14ClN3O2 — CID 134804048

IUPACN-(2-chlorophenyl)-4-(6-methoxypyridazin-3-yl)benzamide
SMILESCOc1ccc(-c2ccc(C(=O)Nc3ccccc3Cl)cc2)nn1
InChIInChI=1S/C18H14ClN3O2/c1-24-17-11-10-15(21-22-17)12-6-8-13(9-7-12)18(23)20-16-5-3-2-4-14(16)19/h2-11H,1H3,(H,20,23)
InChIKeyDQFPSAAWTWRIAF-UHFFFAOYSA-N
MW339.78 g/mol
LogP4.06
Rot. Bonds4

About N-(2-chlorophenyl)-4-(6-methoxypyridazin-3-yl)benzamide

N-(2-chlorophenyl)-4-(6-methoxypyridazin-3-yl)benzamide (PubChem CID 134804048) has the molecular formula C18H14ClN3O2 and a molecular weight of 339.78 g/mol. Its IUPAC name is N-(2-chlorophenyl)-4-(6-methoxypyridazin-3-yl)benzamide.

Molecular Properties

Compound NameN-(2-chlorophenyl)-4-(6-methoxypyridazin-3-yl)benzamide
PubChem CID134804048
Molecular FormulaC18H14ClN3O2
Molecular Weight339.78 g/mol
Exact Mass339.08
IUPAC NameN-(2-chlorophenyl)-4-(6-methoxypyridazin-3-yl)benzamide
SMILESCOc1ccc(-c2ccc(C(=O)Nc3ccccc3Cl)cc2)nn1
InChIInChI=1S/C18H14ClN3O2/c1-24-17-11-10-15(21-22-17)12-6-8-13(9-7-12)18(23)20-16-5-3-2-4-14(16)19/h2-11H,1H3,(H,20,23)
InChIKeyDQFPSAAWTWRIAF-UHFFFAOYSA-N
XLogP4.06
TPSA64.11 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500339.78
LogP ≤ 54.06
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

2-chloro-N-[2-(2-chlorophenyl)ethyl]-5-(6-methoxypyridazin-3-yl)benzamide
CID 18438700
N-[(2-fluorophenyl)methyl]-4-(6-methoxypyridazin-3-yl)benzamide
CID 134801622
4-fluoro-N-[4-(6-methoxypyridazin-3-yl)phenyl]benzamide
CID 7593565
N-[3-(6-ethoxypyridazin-3-yl)phenyl]-2,4-difluorobenzamide
CID 7593643
N-[3-(6-methoxypyridazin-3-yl)phenyl]-2-(trifluoromethyl)benzamide
CID 8670453
N-(3-fluorophenyl)-4-(6-methoxypyridazin-3-yl)benzamide
CID 134800715
2-chloro-N-[2-(4-fluorophenyl)ethyl]-4-(6-methoxypyridazin-3-yl)benzamide
CID 134800894
4-(6-methoxypyridazin-3-yl)-N-[3-(trifluoromethyl)phenyl]benzamide
CID 134801163
2-chloro-N-(4-fluorophenyl)-4-(6-methoxypyridazin-3-yl)benzamide
CID 134801168
N-[(3-fluorophenyl)methyl]-4-(6-methoxypyridazin-3-yl)benzamide
CID 134801201
2-chloro-4-(6-methoxypyridazin-3-yl)-N-(2,2,2-trifluoroethyl)benzamide
CID 134801208
4-(6-methoxypyridazin-3-yl)-N-[[4-(trifluoromethyl)phenyl]methyl]benzamide
CID 134801327

Frequently Asked Questions

What is the IUPAC name of N-(2-chlorophenyl)-4-(6-methoxypyridazin-3-yl)benzamide?
The IUPAC name of N-(2-chlorophenyl)-4-(6-methoxypyridazin-3-yl)benzamide (CID 134804048) is N-(2-chlorophenyl)-4-(6-methoxypyridazin-3-yl)benzamide.
What is the SMILES notation for N-(2-chlorophenyl)-4-(6-methoxypyridazin-3-yl)benzamide?
The canonical SMILES for N-(2-chlorophenyl)-4-(6-methoxypyridazin-3-yl)benzamide is COc1ccc(-c2ccc(C(=O)Nc3ccccc3Cl)cc2)nn1.
What is the InChIKey of N-(2-chlorophenyl)-4-(6-methoxypyridazin-3-yl)benzamide?
The InChIKey is DQFPSAAWTWRIAF-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H14ClN3O2/c1-24-17-11-10-15(21-22-17)12-6-8-13(9-7-12)18(23)20-16-5-3-2-4-14(16)19/h2-11H,1H3,(H,20,23).
What are the key properties of N-(2-chlorophenyl)-4-(6-methoxypyridazin-3-yl)benzamide?
N-(2-chlorophenyl)-4-(6-methoxypyridazin-3-yl)benzamide has a molecular weight of 339.78 g/mol, XLogP of 4.06, 4 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2-chlorophenyl)-4-(6-methoxypyridazin-3-yl)benzamide is sourced from PubChem (CID 134804048), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).