6-(2,6-dichloroanilino)-N-(2-morpholin-4-ylethyl)pyridazine-3-carboxamide

C17H19Cl2N5O2 — CID 109115771

IUPAC6-(2,6-dichloroanilino)-N-(2-morpholin-4-ylethyl)pyridazine-3-carboxamide
SMILESO=C(NCCN1CCOCC1)c1ccc(Nc2c(Cl)cccc2Cl)nn1
InChIInChI=1S/C17H19Cl2N5O2/c18-12-2-1-3-13(19)16(12)21-15-5-4-14(22-23-15)17(25)20-6-7-24-8-10-26-11-9-24/h1-5H,6-11H2,(H,20,25)(H,21,23)
InChIKeyNCBNBJPHQKYKFZ-UHFFFAOYSA-N
MW396.28 g/mol
LogP2.59
Rot. Bonds6

About 6-(2,6-dichloroanilino)-N-(2-morpholin-4-ylethyl)pyridazine-3-carboxamide

6-(2,6-dichloroanilino)-N-(2-morpholin-4-ylethyl)pyridazine-3-carboxamide (PubChem CID 109115771) has the molecular formula C17H19Cl2N5O2 and a molecular weight of 396.28 g/mol. Its IUPAC name is 6-(2,6-dichloroanilino)-N-(2-morpholin-4-ylethyl)pyridazine-3-carboxamide.

Molecular Properties

Compound Name6-(2,6-dichloroanilino)-N-(2-morpholin-4-ylethyl)pyridazine-3-carboxamide
PubChem CID109115771
Molecular FormulaC17H19Cl2N5O2
Molecular Weight396.28 g/mol
Exact Mass395.09
IUPAC Name6-(2,6-dichloroanilino)-N-(2-morpholin-4-ylethyl)pyridazine-3-carboxamide
SMILESO=C(NCCN1CCOCC1)c1ccc(Nc2c(Cl)cccc2Cl)nn1
InChIInChI=1S/C17H19Cl2N5O2/c18-12-2-1-3-13(19)16(12)21-15-5-4-14(22-23-15)17(25)20-6-7-24-8-10-26-11-9-24/h1-5H,6-11H2,(H,20,25)(H,21,23)
InChIKeyNCBNBJPHQKYKFZ-UHFFFAOYSA-N
XLogP2.59
TPSA79.38 Ų
H-Bond Donors2
H-Bond Acceptors6
Rotatable Bonds6
Heavy Atoms26
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500396.28
LogP ≤ 52.59
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 106

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Related Compounds

5-(2,6-dichloroanilino)-N-(2-morpholin-4-ylethyl)pyridine-2-carboxamide
CID 109185766
6-(3-chloro-4-methylanilino)-N-(2-morpholin-4-ylethyl)pyridazine-3-carboxamide
CID 109115731
N-(2-morpholin-4-ylethyl)-6-(2-morpholin-4-ylethylamino)pyridazine-3-carboxamide
CID 109115507
6-(2-fluoroanilino)-N-(2-morpholin-4-ylethyl)pyridazine-3-carboxamide
CID 109115723
6-(3-cyanoanilino)-N-(2-morpholin-4-ylethyl)pyridazine-3-carboxamide
CID 109115775
6-(benzylamino)-N-(2-morpholin-4-ylethyl)pyridazine-3-carboxamide
CID 109115651
2-chloro-N-(2-morpholin-4-ylethyl)benzamide
CID 799090
6-(2,6-dichloroanilino)-N-(2-methoxyethyl)pyridazine-3-carboxamide
CID 109114069
6-(2-methylpropylamino)-N-(2-morpholin-4-ylethyl)pyridazine-3-carboxamide
CID 109110974
6-(3-methylbutylamino)-N-(2-morpholin-4-ylethyl)pyridazine-3-carboxamide
CID 109115691
6-[(4-fluorophenyl)methylamino]-N-(2-morpholin-4-ylethyl)pyridazine-3-carboxamide
CID 109115658
N-[2-(dimethylamino)ethyl]-6-(2-morpholin-4-ylethylamino)pyridazine-3-carboxamide
CID 109115327

Frequently Asked Questions

What is the IUPAC name of 6-(2,6-dichloroanilino)-N-(2-morpholin-4-ylethyl)pyridazine-3-carboxamide?
The IUPAC name of 6-(2,6-dichloroanilino)-N-(2-morpholin-4-ylethyl)pyridazine-3-carboxamide (CID 109115771) is 6-(2,6-dichloroanilino)-N-(2-morpholin-4-ylethyl)pyridazine-3-carboxamide.
What is the SMILES notation for 6-(2,6-dichloroanilino)-N-(2-morpholin-4-ylethyl)pyridazine-3-carboxamide?
The canonical SMILES for 6-(2,6-dichloroanilino)-N-(2-morpholin-4-ylethyl)pyridazine-3-carboxamide is O=C(NCCN1CCOCC1)c1ccc(Nc2c(Cl)cccc2Cl)nn1.
What is the InChIKey of 6-(2,6-dichloroanilino)-N-(2-morpholin-4-ylethyl)pyridazine-3-carboxamide?
The InChIKey is NCBNBJPHQKYKFZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H19Cl2N5O2/c18-12-2-1-3-13(19)16(12)21-15-5-4-14(22-23-15)17(25)20-6-7-24-8-10-26-11-9-24/h1-5H,6-11H2,(H,20,25)(H,21,23).
What are the key properties of 6-(2,6-dichloroanilino)-N-(2-morpholin-4-ylethyl)pyridazine-3-carboxamide?
6-(2,6-dichloroanilino)-N-(2-morpholin-4-ylethyl)pyridazine-3-carboxamide has a molecular weight of 396.28 g/mol, XLogP of 2.59, 6 rotatable bonds, 2 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 6-(2,6-dichloroanilino)-N-(2-morpholin-4-ylethyl)pyridazine-3-carboxamide is sourced from PubChem (CID 109115771), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).