N-[6-(3,4-dihydro-2H-quinolin-1-yl)pyridazin-3-yl]-2-(2-methoxyphenoxy)acetamide

C22H22N4O3 — CID 113046159

IUPACN-[6-(3,4-dihydro-2H-quinolin-1-yl)pyridazin-3-yl]-2-(2-methoxyphenoxy)acetamide
SMILESCOc1ccccc1OCC(=O)Nc1ccc(N2CCCc3ccccc32)nn1
InChIInChI=1S/C22H22N4O3/c1-28-18-10-4-5-11-19(18)29-15-22(27)23-20-12-13-21(25-24-20)26-14-6-8-16-7-2-3-9-17(16)26/h2-5,7,9-13H,6,8,14-15H2,1H3,(H,23,24,27)
InChIKeyAWCMMGSAPBQJLI-UHFFFAOYSA-N
MW390.44 g/mol
LogP3.59
Rot. Bonds6

About N-[6-(3,4-dihydro-2H-quinolin-1-yl)pyridazin-3-yl]-2-(2-methoxyphenoxy)acetamide

N-[6-(3,4-dihydro-2H-quinolin-1-yl)pyridazin-3-yl]-2-(2-methoxyphenoxy)acetamide (PubChem CID 113046159) has the molecular formula C22H22N4O3 and a molecular weight of 390.44 g/mol. Its IUPAC name is N-[6-(3,4-dihydro-2H-quinolin-1-yl)pyridazin-3-yl]-2-(2-methoxyphenoxy)acetamide.

Molecular Properties

Compound NameN-[6-(3,4-dihydro-2H-quinolin-1-yl)pyridazin-3-yl]-2-(2-methoxyphenoxy)acetamide
PubChem CID113046159
Molecular FormulaC22H22N4O3
Molecular Weight390.44 g/mol
Exact Mass390.17
IUPAC NameN-[6-(3,4-dihydro-2H-quinolin-1-yl)pyridazin-3-yl]-2-(2-methoxyphenoxy)acetamide
SMILESCOc1ccccc1OCC(=O)Nc1ccc(N2CCCc3ccccc32)nn1
InChIInChI=1S/C22H22N4O3/c1-28-18-10-4-5-11-19(18)29-15-22(27)23-20-12-13-21(25-24-20)26-14-6-8-16-7-2-3-9-17(16)26/h2-5,7,9-13H,6,8,14-15H2,1H3,(H,23,24,27)
InChIKeyAWCMMGSAPBQJLI-UHFFFAOYSA-N
XLogP3.59
TPSA76.58 Ų
H-Bond Donors1
H-Bond Acceptors6
Rotatable Bonds6
Heavy Atoms29
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500390.44
LogP ≤ 53.59
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 106

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Related Compounds

N-[6-(3,4-dihydro-1H-isoquinolin-2-yl)pyridazin-3-yl]-2-(2-methoxyphenoxy)acetamide
CID 113042446
N-[6-(3,4-dihydro-2H-quinolin-1-yl)pyridazin-3-yl]pentanamide
CID 113046126
N-[5-(2,3-dihydroindol-1-yl)-2-pyridinyl]-2-(2-methoxyphenoxy)acetamide
CID 113031800
N-[6-(3,4-dihydro-2H-quinolin-1-yl)pyridazin-3-yl]-4-fluorobenzamide
CID 113046140
6-(3,4-dihydro-2H-quinolin-1-yl)-N-(2-methoxyphenyl)pyridine-3-carboxamide
CID 84570395
N-(1-acetyl-3,4-dihydro-2H-quinolin-7-yl)-2-(2-methoxyphenoxy)acetamide
CID 7517220
2-(2-methoxyphenoxy)-N-[1-(2-methylpropanoyl)-3,4-dihydro-2H-quinolin-7-yl]acetamide
CID 7517535
2-(3,4-dihydro-2H-quinolin-1-yl)-N-[(2-methoxyphenyl)methyl]pyridine-4-carboxamide
CID 109171028
N-[6-(2,3-dihydroindol-1-yl)pyridazin-3-yl]cyclohexanecarboxamide
CID 113046028
2-(3,4-dihydro-2H-quinolin-1-yl)-N-(2,4-dimethoxyphenyl)pyridine-4-carboxamide
CID 109176550
2-(2-methoxyphenoxy)-N-[6-(4-methylpiperazin-1-yl)pyrimidin-4-yl]acetamide
CID 90543826
N-[5-(3,4-dihydro-2H-quinolin-1-yl)-2-pyridinyl]propanamide
CID 113031855

Frequently Asked Questions

What is the IUPAC name of N-[6-(3,4-dihydro-2H-quinolin-1-yl)pyridazin-3-yl]-2-(2-methoxyphenoxy)acetamide?
The IUPAC name of N-[6-(3,4-dihydro-2H-quinolin-1-yl)pyridazin-3-yl]-2-(2-methoxyphenoxy)acetamide (CID 113046159) is N-[6-(3,4-dihydro-2H-quinolin-1-yl)pyridazin-3-yl]-2-(2-methoxyphenoxy)acetamide.
What is the SMILES notation for N-[6-(3,4-dihydro-2H-quinolin-1-yl)pyridazin-3-yl]-2-(2-methoxyphenoxy)acetamide?
The canonical SMILES for N-[6-(3,4-dihydro-2H-quinolin-1-yl)pyridazin-3-yl]-2-(2-methoxyphenoxy)acetamide is COc1ccccc1OCC(=O)Nc1ccc(N2CCCc3ccccc32)nn1.
What is the InChIKey of N-[6-(3,4-dihydro-2H-quinolin-1-yl)pyridazin-3-yl]-2-(2-methoxyphenoxy)acetamide?
The InChIKey is AWCMMGSAPBQJLI-UHFFFAOYSA-N. The full InChI is InChI=1S/C22H22N4O3/c1-28-18-10-4-5-11-19(18)29-15-22(27)23-20-12-13-21(25-24-20)26-14-6-8-16-7-2-3-9-17(16)26/h2-5,7,9-13H,6,8,14-15H2,1H3,(H,23,24,27).
What are the key properties of N-[6-(3,4-dihydro-2H-quinolin-1-yl)pyridazin-3-yl]-2-(2-methoxyphenoxy)acetamide?
N-[6-(3,4-dihydro-2H-quinolin-1-yl)pyridazin-3-yl]-2-(2-methoxyphenoxy)acetamide has a molecular weight of 390.44 g/mol, XLogP of 3.59, 6 rotatable bonds, 1 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for N-[6-(3,4-dihydro-2H-quinolin-1-yl)pyridazin-3-yl]-2-(2-methoxyphenoxy)acetamide is sourced from PubChem (CID 113046159), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).