6-(diethylamino)-N-(2-morpholin-4-ylphenyl)pyridazine-3-carboxamide

C19H25N5O2 — CID 109124354

IUPAC6-(diethylamino)-N-(2-morpholin-4-ylphenyl)pyridazine-3-carboxamide
SMILESCCN(CC)c1ccc(C(=O)Nc2ccccc2N2CCOCC2)nn1
InChIInChI=1S/C19H25N5O2/c1-3-23(4-2)18-10-9-16(21-22-18)19(25)20-15-7-5-6-8-17(15)24-11-13-26-14-12-24/h5-10H,3-4,11-14H2,1-2H3,(H,20,25)
InChIKeyWNTQQDFSKUUTOL-UHFFFAOYSA-N
MW355.44 g/mol
LogP2.41
Rot. Bonds6

About 6-(diethylamino)-N-(2-morpholin-4-ylphenyl)pyridazine-3-carboxamide

6-(diethylamino)-N-(2-morpholin-4-ylphenyl)pyridazine-3-carboxamide (PubChem CID 109124354) has the molecular formula C19H25N5O2 and a molecular weight of 355.44 g/mol. Its IUPAC name is 6-(diethylamino)-N-(2-morpholin-4-ylphenyl)pyridazine-3-carboxamide.

Molecular Properties

Compound Name6-(diethylamino)-N-(2-morpholin-4-ylphenyl)pyridazine-3-carboxamide
PubChem CID109124354
Molecular FormulaC19H25N5O2
Molecular Weight355.44 g/mol
Exact Mass355.20
IUPAC Name6-(diethylamino)-N-(2-morpholin-4-ylphenyl)pyridazine-3-carboxamide
SMILESCCN(CC)c1ccc(C(=O)Nc2ccccc2N2CCOCC2)nn1
InChIInChI=1S/C19H25N5O2/c1-3-23(4-2)18-10-9-16(21-22-18)19(25)20-15-7-5-6-8-17(15)24-11-13-26-14-12-24/h5-10H,3-4,11-14H2,1-2H3,(H,20,25)
InChIKeyWNTQQDFSKUUTOL-UHFFFAOYSA-N
XLogP2.41
TPSA70.59 Ų
H-Bond Donors1
H-Bond Acceptors6
Rotatable Bonds6
Heavy Atoms26
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500355.44
LogP ≤ 52.41
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 106

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Frequently Asked Questions

What is the IUPAC name of 6-(diethylamino)-N-(2-morpholin-4-ylphenyl)pyridazine-3-carboxamide?
The IUPAC name of 6-(diethylamino)-N-(2-morpholin-4-ylphenyl)pyridazine-3-carboxamide (CID 109124354) is 6-(diethylamino)-N-(2-morpholin-4-ylphenyl)pyridazine-3-carboxamide.
What is the SMILES notation for 6-(diethylamino)-N-(2-morpholin-4-ylphenyl)pyridazine-3-carboxamide?
The canonical SMILES for 6-(diethylamino)-N-(2-morpholin-4-ylphenyl)pyridazine-3-carboxamide is CCN(CC)c1ccc(C(=O)Nc2ccccc2N2CCOCC2)nn1.
What is the InChIKey of 6-(diethylamino)-N-(2-morpholin-4-ylphenyl)pyridazine-3-carboxamide?
The InChIKey is WNTQQDFSKUUTOL-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H25N5O2/c1-3-23(4-2)18-10-9-16(21-22-18)19(25)20-15-7-5-6-8-17(15)24-11-13-26-14-12-24/h5-10H,3-4,11-14H2,1-2H3,(H,20,25).
What are the key properties of 6-(diethylamino)-N-(2-morpholin-4-ylphenyl)pyridazine-3-carboxamide?
6-(diethylamino)-N-(2-morpholin-4-ylphenyl)pyridazine-3-carboxamide has a molecular weight of 355.44 g/mol, XLogP of 2.41, 6 rotatable bonds, 1 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 6-(diethylamino)-N-(2-morpholin-4-ylphenyl)pyridazine-3-carboxamide is sourced from PubChem (CID 109124354), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).