4-[2-(4-methyl-6-naphthalen-2-ylpyridazin-3-yl)oxyethyl]morpholine;hydrochloride

C21H24ClN3O2 — CID 122361319

IUPAC4-[2-(4-methyl-6-naphthalen-2-ylpyridazin-3-yl)oxyethyl]morpholine;hydrochloride
SMILESCc1cc(-c2ccc3ccccc3c2)nnc1OCCN1CCOCC1.Cl
InChIInChI=1S/C21H23N3O2.ClH/c1-16-14-20(19-7-6-17-4-2-3-5-18(17)15-19)22-23-21(16)26-13-10-24-8-11-25-12-9-24;/h2-7,14-15H,8-13H2,1H3;1H
InChIKeyDVSRVOWCOFCJLH-UHFFFAOYSA-N
MW385.90 g/mol
LogP3.74
Rot. Bonds5

About 4-[2-(4-methyl-6-naphthalen-2-ylpyridazin-3-yl)oxyethyl]morpholine;hydrochloride

4-[2-(4-methyl-6-naphthalen-2-ylpyridazin-3-yl)oxyethyl]morpholine;hydrochloride (PubChem CID 122361319) has the molecular formula C21H24ClN3O2 and a molecular weight of 385.90 g/mol. Its IUPAC name is 4-[2-(4-methyl-6-naphthalen-2-ylpyridazin-3-yl)oxyethyl]morpholine;hydrochloride.

Molecular Properties

Compound Name4-[2-(4-methyl-6-naphthalen-2-ylpyridazin-3-yl)oxyethyl]morpholine;hydrochloride
PubChem CID122361319
Molecular FormulaC21H24ClN3O2
Molecular Weight385.90 g/mol
Exact Mass385.16
IUPAC Name4-[2-(4-methyl-6-naphthalen-2-ylpyridazin-3-yl)oxyethyl]morpholine;hydrochloride
SMILESCc1cc(-c2ccc3ccccc3c2)nnc1OCCN1CCOCC1.Cl
InChIInChI=1S/C21H23N3O2.ClH/c1-16-14-20(19-7-6-17-4-2-3-5-18(17)15-19)22-23-21(16)26-13-10-24-8-11-25-12-9-24;/h2-7,14-15H,8-13H2,1H3;1H
InChIKeyDVSRVOWCOFCJLH-UHFFFAOYSA-N
XLogP3.74
TPSA47.48 Ų
H-Bond Donors
H-Bond Acceptors5
Rotatable Bonds5
Heavy Atoms27
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500385.90
LogP ≤ 53.74
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 105

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Related Compounds

US11208399, Example 42
CID 155284612
3-[2-(1-Benzylpiperidin-4-yl)ethoxy]-6-phenylpyridazine;hydrate;dihydrochloride
CID 49860482
N,N-diethyl-2-[4-(4-methoxyphenyl)phthalazin-1-yl]oxyethanamine
CID 5348049
1-[2-(Morpholin-4-yl)ethoxy]-4-phenylphthalazine
CID 662348
1-(4-Methylphenyl)-4-[2-(morpholin-4-yl)ethoxy]phthalazine
CID 663149
N,N-diethyl-2-[4-(4-methylphenyl)phthalazin-1-yl]oxyethanamine
CID 2885087
6-Methyl-3-[(2-methylphenyl)methoxy]-4-[3-(trifluoromethyl)phenyl]pyridazine
CID 76323832
Phthalazine, 4-benzyl-1-(2-(diethylamino)ethoxy)-, hydrochloride
CID 6410582
Phthalazine, 4-benzyl-1-(2-(dimethylamino)ethoxy)-, hydrochloride
CID 6410584
Phthalazine, 4-benzyl-1-(3-(dimethylamino)propoxy)-, hydrochloride
CID 6410586
6-Methyl-3-[(4-methylphenyl)methoxy]-4-[3-(trifluoromethyl)phenyl]pyridazine
CID 76334651
1-(4-Methylphenyl)-4-propoxyphthalazine
CID 2885396

Frequently Asked Questions

What is the IUPAC name of 4-[2-(4-methyl-6-naphthalen-2-ylpyridazin-3-yl)oxyethyl]morpholine;hydrochloride?
The IUPAC name of 4-[2-(4-methyl-6-naphthalen-2-ylpyridazin-3-yl)oxyethyl]morpholine;hydrochloride (CID 122361319) is 4-[2-(4-methyl-6-naphthalen-2-ylpyridazin-3-yl)oxyethyl]morpholine;hydrochloride.
What is the SMILES notation for 4-[2-(4-methyl-6-naphthalen-2-ylpyridazin-3-yl)oxyethyl]morpholine;hydrochloride?
The canonical SMILES for 4-[2-(4-methyl-6-naphthalen-2-ylpyridazin-3-yl)oxyethyl]morpholine;hydrochloride is Cc1cc(-c2ccc3ccccc3c2)nnc1OCCN1CCOCC1.Cl.
What is the InChIKey of 4-[2-(4-methyl-6-naphthalen-2-ylpyridazin-3-yl)oxyethyl]morpholine;hydrochloride?
The InChIKey is DVSRVOWCOFCJLH-UHFFFAOYSA-N. The full InChI is InChI=1S/C21H23N3O2.ClH/c1-16-14-20(19-7-6-17-4-2-3-5-18(17)15-19)22-23-21(16)26-13-10-24-8-11-25-12-9-24;/h2-7,14-15H,8-13H2,1H3;1H.
What are the key properties of 4-[2-(4-methyl-6-naphthalen-2-ylpyridazin-3-yl)oxyethyl]morpholine;hydrochloride?
4-[2-(4-methyl-6-naphthalen-2-ylpyridazin-3-yl)oxyethyl]morpholine;hydrochloride has a molecular weight of 385.90 g/mol, XLogP of 3.74, 5 rotatable bonds, 0 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 4-[2-(4-methyl-6-naphthalen-2-ylpyridazin-3-yl)oxyethyl]morpholine;hydrochloride is sourced from PubChem (CID 122361319), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).