6-(N-ethylanilino)-N-(4-propan-2-yloxyphenyl)pyridazine-3-carboxamide

C22H24N4O2 — CID 109128041

IUPAC6-(N-ethylanilino)-N-(4-propan-2-yloxyphenyl)pyridazine-3-carboxamide
SMILESCCN(c1ccccc1)c1ccc(C(=O)Nc2ccc(OC(C)C)cc2)nn1
InChIInChI=1S/C22H24N4O2/c1-4-26(18-8-6-5-7-9-18)21-15-14-20(24-25-21)22(27)23-17-10-12-19(13-11-17)28-16(2)3/h5-16H,4H2,1-3H3,(H,23,27)
InChIKeyDFSPTWLRNNXQNK-UHFFFAOYSA-N
MW376.46 g/mol
LogP4.67
Rot. Bonds7

About 6-(N-ethylanilino)-N-(4-propan-2-yloxyphenyl)pyridazine-3-carboxamide

6-(N-ethylanilino)-N-(4-propan-2-yloxyphenyl)pyridazine-3-carboxamide (PubChem CID 109128041) has the molecular formula C22H24N4O2 and a molecular weight of 376.46 g/mol. Its IUPAC name is 6-(N-ethylanilino)-N-(4-propan-2-yloxyphenyl)pyridazine-3-carboxamide.

Molecular Properties

Compound Name6-(N-ethylanilino)-N-(4-propan-2-yloxyphenyl)pyridazine-3-carboxamide
PubChem CID109128041
Molecular FormulaC22H24N4O2
Molecular Weight376.46 g/mol
Exact Mass376.19
IUPAC Name6-(N-ethylanilino)-N-(4-propan-2-yloxyphenyl)pyridazine-3-carboxamide
SMILESCCN(c1ccccc1)c1ccc(C(=O)Nc2ccc(OC(C)C)cc2)nn1
InChIInChI=1S/C22H24N4O2/c1-4-26(18-8-6-5-7-9-18)21-15-14-20(24-25-21)22(27)23-17-10-12-19(13-11-17)28-16(2)3/h5-16H,4H2,1-3H3,(H,23,27)
InChIKeyDFSPTWLRNNXQNK-UHFFFAOYSA-N
XLogP4.67
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 ≤ 54.67
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Related Compounds

N-(4-ethoxyphenyl)-6-(N-ethylanilino)pyridazine-3-carboxamide
CID 109128038
5-(N-ethylanilino)-N-(4-methoxyphenyl)pyrazine-2-carboxamide
CID 109291797
N-(2,4-difluorophenyl)-6-(N-ethylanilino)pyridazine-3-carboxamide
CID 109128062
6-[2-ethoxyethyl(methyl)amino]-N-phenylpyridazine-3-carboxamide
CID 133445922
6-(N-methylanilino)-N-(4-propan-2-yloxyphenyl)pyridine-3-carboxamide
CID 109162323
6-(diethylamino)-N-(2-propan-2-yloxyphenyl)pyridazine-3-carboxamide
CID 109124332
6-[ethyl-[(4-methoxyphenyl)methyl]amino]-N-phenylpyridazine-3-carboxamide
CID 133384179
6-(diethylamino)-N-(4-propan-2-ylphenyl)pyridazine-3-carboxamide
CID 109124305
N-[4-(diethylamino)phenyl]-6-phenylpyridazine-3-carboxamide
CID 113200658
6-(2-methoxyethylamino)-N-(4-propan-2-yloxyphenyl)pyridazine-3-carboxamide
CID 109113837
6-(N-methylanilino)-N-[4-(trifluoromethyl)phenyl]pyridazine-3-carboxamide
CID 109127184
N-(4-phenoxyphenyl)-6-propan-2-ylpyridazine-3-carboxamide
CID 113200474

Frequently Asked Questions

What is the IUPAC name of 6-(N-ethylanilino)-N-(4-propan-2-yloxyphenyl)pyridazine-3-carboxamide?
The IUPAC name of 6-(N-ethylanilino)-N-(4-propan-2-yloxyphenyl)pyridazine-3-carboxamide (CID 109128041) is 6-(N-ethylanilino)-N-(4-propan-2-yloxyphenyl)pyridazine-3-carboxamide.
What is the SMILES notation for 6-(N-ethylanilino)-N-(4-propan-2-yloxyphenyl)pyridazine-3-carboxamide?
The canonical SMILES for 6-(N-ethylanilino)-N-(4-propan-2-yloxyphenyl)pyridazine-3-carboxamide is CCN(c1ccccc1)c1ccc(C(=O)Nc2ccc(OC(C)C)cc2)nn1.
What is the InChIKey of 6-(N-ethylanilino)-N-(4-propan-2-yloxyphenyl)pyridazine-3-carboxamide?
The InChIKey is DFSPTWLRNNXQNK-UHFFFAOYSA-N. The full InChI is InChI=1S/C22H24N4O2/c1-4-26(18-8-6-5-7-9-18)21-15-14-20(24-25-21)22(27)23-17-10-12-19(13-11-17)28-16(2)3/h5-16H,4H2,1-3H3,(H,23,27).
What are the key properties of 6-(N-ethylanilino)-N-(4-propan-2-yloxyphenyl)pyridazine-3-carboxamide?
6-(N-ethylanilino)-N-(4-propan-2-yloxyphenyl)pyridazine-3-carboxamide has a molecular weight of 376.46 g/mol, XLogP of 4.67, 7 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 6-(N-ethylanilino)-N-(4-propan-2-yloxyphenyl)pyridazine-3-carboxamide is sourced from PubChem (CID 109128041), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).