6-[(4-fluorophenyl)methylamino]-N-(2-morpholin-4-ylethyl)pyridazine-3-carboxamide

C18H22FN5O2 — CID 109115658

IUPAC6-[(4-fluorophenyl)methylamino]-N-(2-morpholin-4-ylethyl)pyridazine-3-carboxamide
SMILESO=C(NCCN1CCOCC1)c1ccc(NCc2ccc(F)cc2)nn1
InChIInChI=1S/C18H22FN5O2/c19-15-3-1-14(2-4-15)13-21-17-6-5-16(22-23-17)18(25)20-7-8-24-9-11-26-12-10-24/h1-6H,7-13H2,(H,20,25)(H,21,23)
InChIKeyWJUWBBHEXBBKDN-UHFFFAOYSA-N
MW359.41 g/mol
LogP1.29
Rot. Bonds7

About 6-[(4-fluorophenyl)methylamino]-N-(2-morpholin-4-ylethyl)pyridazine-3-carboxamide

6-[(4-fluorophenyl)methylamino]-N-(2-morpholin-4-ylethyl)pyridazine-3-carboxamide (PubChem CID 109115658) has the molecular formula C18H22FN5O2 and a molecular weight of 359.41 g/mol. Its IUPAC name is 6-[(4-fluorophenyl)methylamino]-N-(2-morpholin-4-ylethyl)pyridazine-3-carboxamide.

Molecular Properties

Compound Name6-[(4-fluorophenyl)methylamino]-N-(2-morpholin-4-ylethyl)pyridazine-3-carboxamide
PubChem CID109115658
Molecular FormulaC18H22FN5O2
Molecular Weight359.41 g/mol
Exact Mass359.18
IUPAC Name6-[(4-fluorophenyl)methylamino]-N-(2-morpholin-4-ylethyl)pyridazine-3-carboxamide
SMILESO=C(NCCN1CCOCC1)c1ccc(NCc2ccc(F)cc2)nn1
InChIInChI=1S/C18H22FN5O2/c19-15-3-1-14(2-4-15)13-21-17-6-5-16(22-23-17)18(25)20-7-8-24-9-11-26-12-10-24/h1-6H,7-13H2,(H,20,25)(H,21,23)
InChIKeyWJUWBBHEXBBKDN-UHFFFAOYSA-N
XLogP1.29
TPSA79.38 Ų
H-Bond Donors2
H-Bond Acceptors6
Rotatable Bonds7
Heavy Atoms26
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500359.41
LogP ≤ 51.29
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 106

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Related Compounds

6-(benzylamino)-N-(2-morpholin-4-ylethyl)pyridazine-3-carboxamide
CID 109115651
N-(2-morpholin-4-ylethyl)-6-(2-morpholin-4-ylethylamino)pyridazine-3-carboxamide
CID 109115507
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-(2-fluoroanilino)-N-(2-morpholin-4-ylethyl)pyridazine-3-carboxamide
CID 109115723
5-[2-(4-fluorophenyl)ethylamino]-N-(2-morpholin-4-ylethyl)pyridine-2-carboxamide
CID 109185666
2-(4-fluorophenyl)-N-[6-(2-morpholin-4-ylethylamino)pyridazin-3-yl]acetamide
CID 113040035
N-[2-(dimethylamino)ethyl]-6-(2-morpholin-4-ylethylamino)pyridazine-3-carboxamide
CID 109115327
6-(2-morpholin-4-ylethylamino)-N-pentylpyridazine-3-carboxamide
CID 109115555
N-(2-methylpropyl)-6-(2-morpholin-4-ylethylamino)pyridazine-3-carboxamide
CID 109111166
N-[3-(dimethylamino)propyl]-6-(2-morpholin-4-ylethylamino)pyridazine-3-carboxamide
CID 109115508
6-[(4-fluorophenyl)methylamino]-N-(2-phenylethyl)pyridazine-3-carboxamide
CID 109119413

Frequently Asked Questions

What is the IUPAC name of 6-[(4-fluorophenyl)methylamino]-N-(2-morpholin-4-ylethyl)pyridazine-3-carboxamide?
The IUPAC name of 6-[(4-fluorophenyl)methylamino]-N-(2-morpholin-4-ylethyl)pyridazine-3-carboxamide (CID 109115658) is 6-[(4-fluorophenyl)methylamino]-N-(2-morpholin-4-ylethyl)pyridazine-3-carboxamide.
What is the SMILES notation for 6-[(4-fluorophenyl)methylamino]-N-(2-morpholin-4-ylethyl)pyridazine-3-carboxamide?
The canonical SMILES for 6-[(4-fluorophenyl)methylamino]-N-(2-morpholin-4-ylethyl)pyridazine-3-carboxamide is O=C(NCCN1CCOCC1)c1ccc(NCc2ccc(F)cc2)nn1.
What is the InChIKey of 6-[(4-fluorophenyl)methylamino]-N-(2-morpholin-4-ylethyl)pyridazine-3-carboxamide?
The InChIKey is WJUWBBHEXBBKDN-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H22FN5O2/c19-15-3-1-14(2-4-15)13-21-17-6-5-16(22-23-17)18(25)20-7-8-24-9-11-26-12-10-24/h1-6H,7-13H2,(H,20,25)(H,21,23).
What are the key properties of 6-[(4-fluorophenyl)methylamino]-N-(2-morpholin-4-ylethyl)pyridazine-3-carboxamide?
6-[(4-fluorophenyl)methylamino]-N-(2-morpholin-4-ylethyl)pyridazine-3-carboxamide has a molecular weight of 359.41 g/mol, XLogP of 1.29, 7 rotatable bonds, 2 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 6-[(4-fluorophenyl)methylamino]-N-(2-morpholin-4-ylethyl)pyridazine-3-carboxamide is sourced from PubChem (CID 109115658), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).