6-[2-(4-methoxyphenyl)ethylamino]-N-methylpyridazine-3-carboxamide

C15H18N4O2 — CID 79005945

IUPAC6-[2-(4-methoxyphenyl)ethylamino]-N-methylpyridazine-3-carboxamide
SMILESCNC(=O)c1ccc(NCCc2ccc(OC)cc2)nn1
InChIInChI=1S/C15H18N4O2/c1-16-15(20)13-7-8-14(19-18-13)17-10-9-11-3-5-12(21-2)6-4-11/h3-8H,9-10H2,1-2H3,(H,16,20)(H,17,19)
InChIKeyHSHMHWRZAIJWTC-UHFFFAOYSA-N
MW286.34 g/mol
LogP1.50
Rot. Bonds6

About 6-[2-(4-methoxyphenyl)ethylamino]-N-methylpyridazine-3-carboxamide

6-[2-(4-methoxyphenyl)ethylamino]-N-methylpyridazine-3-carboxamide (PubChem CID 79005945) has the molecular formula C15H18N4O2 and a molecular weight of 286.34 g/mol. Its IUPAC name is 6-[2-(4-methoxyphenyl)ethylamino]-N-methylpyridazine-3-carboxamide.

Molecular Properties

Compound Name6-[2-(4-methoxyphenyl)ethylamino]-N-methylpyridazine-3-carboxamide
PubChem CID79005945
Molecular FormulaC15H18N4O2
Molecular Weight286.34 g/mol
Exact Mass286.14
IUPAC Name6-[2-(4-methoxyphenyl)ethylamino]-N-methylpyridazine-3-carboxamide
SMILESCNC(=O)c1ccc(NCCc2ccc(OC)cc2)nn1
InChIInChI=1S/C15H18N4O2/c1-16-15(20)13-7-8-14(19-18-13)17-10-9-11-3-5-12(21-2)6-4-11/h3-8H,9-10H2,1-2H3,(H,16,20)(H,17,19)
InChIKeyHSHMHWRZAIJWTC-UHFFFAOYSA-N
XLogP1.50
TPSA76.14 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds6
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500286.34
LogP ≤ 51.50
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

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Related Compounds

6-[2-(4-methoxyphenyl)ethylamino]pyridazine-3-carboxylic acid
CID 60791797
6-[2-(4-methoxyphenyl)ethylamino]-N-(4-methylphenyl)pyridazine-3-carboxamide
CID 109122465
N-(2-fluorophenyl)-6-[2-(4-methoxyphenyl)ethylamino]pyridazine-3-carboxamide
CID 109122480
N-[2-(4-methoxyphenyl)ethyl]-6-(3-phenylpropylamino)pyridazine-3-carboxamide
CID 109122514
N-(3,4-difluorophenyl)-6-[2-(4-methoxyphenyl)ethylamino]pyridazine-3-carboxamide
CID 109122508
6-[2-(4-methoxyphenoxy)ethylamino]-N-(2-phenylethyl)pyridazine-3-carboxamide
CID 109121641
[6-[2-(4-methoxyphenyl)ethylamino]pyridazin-3-yl]-(4-methylpiperidin-1-yl)methanone
CID 109113349
N-[6-[2-(4-methoxyphenyl)ethylamino]pyridazin-3-yl]cyclopropanecarboxamide
CID 113042762
6-[2-(2-methoxyethoxy)ethylamino]-N-methylpyridazine-3-carboxamide
CID 79207000
N-[(4-methoxyphenyl)methyl]-6-(3-methoxypropylamino)pyridazine-3-carboxamide
CID 109114105
N-[2-(4-fluorophenyl)ethyl]-6-[2-(3-methoxyphenyl)ethylamino]pyridazine-3-carboxamide
CID 109122136
6-[(4-methoxyphenyl)methylamino]-N-propan-2-ylpyridazine-3-carboxamide
CID 109109629

Frequently Asked Questions

What is the IUPAC name of 6-[2-(4-methoxyphenyl)ethylamino]-N-methylpyridazine-3-carboxamide?
The IUPAC name of 6-[2-(4-methoxyphenyl)ethylamino]-N-methylpyridazine-3-carboxamide (CID 79005945) is 6-[2-(4-methoxyphenyl)ethylamino]-N-methylpyridazine-3-carboxamide.
What is the SMILES notation for 6-[2-(4-methoxyphenyl)ethylamino]-N-methylpyridazine-3-carboxamide?
The canonical SMILES for 6-[2-(4-methoxyphenyl)ethylamino]-N-methylpyridazine-3-carboxamide is CNC(=O)c1ccc(NCCc2ccc(OC)cc2)nn1.
What is the InChIKey of 6-[2-(4-methoxyphenyl)ethylamino]-N-methylpyridazine-3-carboxamide?
The InChIKey is HSHMHWRZAIJWTC-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H18N4O2/c1-16-15(20)13-7-8-14(19-18-13)17-10-9-11-3-5-12(21-2)6-4-11/h3-8H,9-10H2,1-2H3,(H,16,20)(H,17,19).
What are the key properties of 6-[2-(4-methoxyphenyl)ethylamino]-N-methylpyridazine-3-carboxamide?
6-[2-(4-methoxyphenyl)ethylamino]-N-methylpyridazine-3-carboxamide has a molecular weight of 286.34 g/mol, XLogP of 1.50, 6 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 6-[2-(4-methoxyphenyl)ethylamino]-N-methylpyridazine-3-carboxamide is sourced from PubChem (CID 79005945), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).