6-(N-ethyl-3-methylanilino)-N-[(2-methoxyphenyl)methyl]pyridazine-3-carboxamide

C22H24N4O2 — CID 109120151

IUPAC6-(N-ethyl-3-methylanilino)-N-[(2-methoxyphenyl)methyl]pyridazine-3-carboxamide
SMILESCCN(c1cccc(C)c1)c1ccc(C(=O)NCc2ccccc2OC)nn1
InChIInChI=1S/C22H24N4O2/c1-4-26(18-10-7-8-16(2)14-18)21-13-12-19(24-25-21)22(27)23-15-17-9-5-6-11-20(17)28-3/h5-14H,4,15H2,1-3H3,(H,23,27)
InChIKeyMDDWPLSQDIIVON-UHFFFAOYSA-N
MW376.46 g/mol
LogP3.88
Rot. Bonds7

About 6-(N-ethyl-3-methylanilino)-N-[(2-methoxyphenyl)methyl]pyridazine-3-carboxamide

6-(N-ethyl-3-methylanilino)-N-[(2-methoxyphenyl)methyl]pyridazine-3-carboxamide (PubChem CID 109120151) has the molecular formula C22H24N4O2 and a molecular weight of 376.46 g/mol. Its IUPAC name is 6-(N-ethyl-3-methylanilino)-N-[(2-methoxyphenyl)methyl]pyridazine-3-carboxamide.

Molecular Properties

Compound Name6-(N-ethyl-3-methylanilino)-N-[(2-methoxyphenyl)methyl]pyridazine-3-carboxamide
PubChem CID109120151
Molecular FormulaC22H24N4O2
Molecular Weight376.46 g/mol
Exact Mass376.19
IUPAC Name6-(N-ethyl-3-methylanilino)-N-[(2-methoxyphenyl)methyl]pyridazine-3-carboxamide
SMILESCCN(c1cccc(C)c1)c1ccc(C(=O)NCc2ccccc2OC)nn1
InChIInChI=1S/C22H24N4O2/c1-4-26(18-10-7-8-16(2)14-18)21-13-12-19(24-25-21)22(27)23-15-17-9-5-6-11-20(17)28-3/h5-14H,4,15H2,1-3H3,(H,23,27)
InChIKeyMDDWPLSQDIIVON-UHFFFAOYSA-N
XLogP3.88
TPSA67.35 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds7
Heavy Atoms28
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500376.46
LogP ≤ 53.88
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Related Compounds

5-(N-ethyl-3-methylanilino)-N-[(2-methoxyphenyl)methyl]pyridine-2-carboxamide
CID 109190248
6-(N-ethyl-3-methylanilino)-N-prop-2-enylpyridazine-3-carboxamide
CID 109110572
N-tert-butyl-6-(N-ethyl-3-methylanilino)pyridazine-3-carboxamide
CID 109124947
6-(diethylamino)-N-[(2-methoxyphenyl)methyl]-2-methylpyrimidine-4-carboxamide
CID 109370286
2-(N-ethyl-3-methylanilino)-N-[(2-methoxyphenyl)methyl]acetamide
CID 108998497
methyl 3-[[6-(N-ethyl-3-methylanilino)pyridazine-3-carbonyl]amino]benzoate
CID 109129968
5-(N-ethyl-3-methylanilino)-N-[(2-methylphenyl)methyl]pyrazine-2-carboxamide
CID 109280082
N-[6-(N-ethyl-3-methylanilino)pyridazin-3-yl]-3,4-dimethoxybenzamide
CID 113051420
6-(N-ethyl-3-methylanilino)-N-[(2-fluorophenyl)methyl]-2-methylpyrimidine-4-carboxamide
CID 109369741
6-N-ethyl-2-N-[(2-methoxyphenyl)methyl]-6-N-phenylpyridine-2,6-dicarboxamide
CID 109097988
N-[(2-methoxyphenyl)methyl]-5-(3-methylanilino)pyridine-2-carboxamide
CID 109190188
N-[6-(N-ethyl-3-methylanilino)-3-pyridinyl]-2-(2-methoxyphenoxy)acetamide
CID 113022991

Frequently Asked Questions

What is the IUPAC name of 6-(N-ethyl-3-methylanilino)-N-[(2-methoxyphenyl)methyl]pyridazine-3-carboxamide?
The IUPAC name of 6-(N-ethyl-3-methylanilino)-N-[(2-methoxyphenyl)methyl]pyridazine-3-carboxamide (CID 109120151) is 6-(N-ethyl-3-methylanilino)-N-[(2-methoxyphenyl)methyl]pyridazine-3-carboxamide.
What is the SMILES notation for 6-(N-ethyl-3-methylanilino)-N-[(2-methoxyphenyl)methyl]pyridazine-3-carboxamide?
The canonical SMILES for 6-(N-ethyl-3-methylanilino)-N-[(2-methoxyphenyl)methyl]pyridazine-3-carboxamide is CCN(c1cccc(C)c1)c1ccc(C(=O)NCc2ccccc2OC)nn1.
What is the InChIKey of 6-(N-ethyl-3-methylanilino)-N-[(2-methoxyphenyl)methyl]pyridazine-3-carboxamide?
The InChIKey is MDDWPLSQDIIVON-UHFFFAOYSA-N. The full InChI is InChI=1S/C22H24N4O2/c1-4-26(18-10-7-8-16(2)14-18)21-13-12-19(24-25-21)22(27)23-15-17-9-5-6-11-20(17)28-3/h5-14H,4,15H2,1-3H3,(H,23,27).
What are the key properties of 6-(N-ethyl-3-methylanilino)-N-[(2-methoxyphenyl)methyl]pyridazine-3-carboxamide?
6-(N-ethyl-3-methylanilino)-N-[(2-methoxyphenyl)methyl]pyridazine-3-carboxamide has a molecular weight of 376.46 g/mol, XLogP of 3.88, 7 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 6-(N-ethyl-3-methylanilino)-N-[(2-methoxyphenyl)methyl]pyridazine-3-carboxamide is sourced from PubChem (CID 109120151), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).