N-[2-(2-fluorophenyl)ethyl]-6-(2-methoxyanilino)pyridazine-3-carboxamide

C20H19FN4O2 — CID 109122026

IUPACN-[2-(2-fluorophenyl)ethyl]-6-(2-methoxyanilino)pyridazine-3-carboxamide
SMILESCOc1ccccc1Nc1ccc(C(=O)NCCc2ccccc2F)nn1
InChIInChI=1S/C20H19FN4O2/c1-27-18-9-5-4-8-16(18)23-19-11-10-17(24-25-19)20(26)22-13-12-14-6-2-3-7-15(14)21/h2-11H,12-13H2,1H3,(H,22,26)(H,23,25)
InChIKeyQWCOIRWARYZUIT-UHFFFAOYSA-N
MW366.40 g/mol
LogP3.34
Rot. Bonds7

About N-[2-(2-fluorophenyl)ethyl]-6-(2-methoxyanilino)pyridazine-3-carboxamide

N-[2-(2-fluorophenyl)ethyl]-6-(2-methoxyanilino)pyridazine-3-carboxamide (PubChem CID 109122026) has the molecular formula C20H19FN4O2 and a molecular weight of 366.40 g/mol. Its IUPAC name is N-[2-(2-fluorophenyl)ethyl]-6-(2-methoxyanilino)pyridazine-3-carboxamide.

Molecular Properties

Compound NameN-[2-(2-fluorophenyl)ethyl]-6-(2-methoxyanilino)pyridazine-3-carboxamide
PubChem CID109122026
Molecular FormulaC20H19FN4O2
Molecular Weight366.40 g/mol
Exact Mass366.15
IUPAC NameN-[2-(2-fluorophenyl)ethyl]-6-(2-methoxyanilino)pyridazine-3-carboxamide
SMILESCOc1ccccc1Nc1ccc(C(=O)NCCc2ccccc2F)nn1
InChIInChI=1S/C20H19FN4O2/c1-27-18-9-5-4-8-16(18)23-19-11-10-17(24-25-19)20(26)22-13-12-14-6-2-3-7-15(14)21/h2-11H,12-13H2,1H3,(H,22,26)(H,23,25)
InChIKeyQWCOIRWARYZUIT-UHFFFAOYSA-N
XLogP3.34
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 ≤ 53.34
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

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Related Compounds

6-(2,4-dimethoxyanilino)-N-[2-(2-fluorophenyl)ethyl]pyridazine-3-carboxamide
CID 109122035
6-(2-ethoxyanilino)-N-[2-(2-methoxyphenyl)ethyl]pyridazine-3-carboxamide
CID 109122308
N-[2-(2-fluorophenyl)ethyl]-5-(2-methoxyanilino)pyrazine-2-carboxamide
CID 109284290
6-(2-methoxyanilino)-N-pentylpyridazine-3-carboxamide
CID 109125507
6-(4-methoxyanilino)-N-[2-(2-methoxyphenyl)ethyl]pyridazine-3-carboxamide
CID 109122307
6-(2-methoxyanilino)-N-[2-(3-methoxyphenyl)ethyl]pyridazine-3-carboxamide
CID 109122427
N-[2-(2-fluorophenyl)ethyl]-6-(2-methoxyethylamino)pyridazine-3-carboxamide
CID 109113743
N-[2-(cyclohexen-1-yl)ethyl]-6-(2-methoxyanilino)pyridazine-3-carboxamide
CID 109113677
6-(2-fluoroanilino)-N-(2-methoxyethyl)pyridazine-3-carboxamide
CID 109114000
6-(2,4-difluoroanilino)-N-[(2-methoxyphenyl)methyl]pyridazine-3-carboxamide
CID 109120146
N-[(3,4-dimethoxyphenyl)methyl]-6-(2-methoxyanilino)pyridazine-3-carboxamide
CID 109123487
N-(2,5-dimethoxyphenyl)-6-[2-(2-fluorophenyl)ethylamino]pyridazine-3-carboxamide
CID 109121963

Frequently Asked Questions

What is the IUPAC name of N-[2-(2-fluorophenyl)ethyl]-6-(2-methoxyanilino)pyridazine-3-carboxamide?
The IUPAC name of N-[2-(2-fluorophenyl)ethyl]-6-(2-methoxyanilino)pyridazine-3-carboxamide (CID 109122026) is N-[2-(2-fluorophenyl)ethyl]-6-(2-methoxyanilino)pyridazine-3-carboxamide.
What is the SMILES notation for N-[2-(2-fluorophenyl)ethyl]-6-(2-methoxyanilino)pyridazine-3-carboxamide?
The canonical SMILES for N-[2-(2-fluorophenyl)ethyl]-6-(2-methoxyanilino)pyridazine-3-carboxamide is COc1ccccc1Nc1ccc(C(=O)NCCc2ccccc2F)nn1.
What is the InChIKey of N-[2-(2-fluorophenyl)ethyl]-6-(2-methoxyanilino)pyridazine-3-carboxamide?
The InChIKey is QWCOIRWARYZUIT-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H19FN4O2/c1-27-18-9-5-4-8-16(18)23-19-11-10-17(24-25-19)20(26)22-13-12-14-6-2-3-7-15(14)21/h2-11H,12-13H2,1H3,(H,22,26)(H,23,25).
What are the key properties of N-[2-(2-fluorophenyl)ethyl]-6-(2-methoxyanilino)pyridazine-3-carboxamide?
N-[2-(2-fluorophenyl)ethyl]-6-(2-methoxyanilino)pyridazine-3-carboxamide has a molecular weight of 366.40 g/mol, XLogP of 3.34, 7 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N-[2-(2-fluorophenyl)ethyl]-6-(2-methoxyanilino)pyridazine-3-carboxamide is sourced from PubChem (CID 109122026), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).