[6-[[2-(2,6-dichlorophenyl)-1H-imidazo[4,5-c]pyridin-4-yl]amino]pyridazin-3-yl]-morpholin-4-ylmethanone

C21H17Cl2N7O2 — CID 67388554

IUPAC[6-[[2-(2,6-dichlorophenyl)-1H-imidazo[4,5-c]pyridin-4-yl]amino]pyridazin-3-yl]-morpholin-4-ylmethanone
SMILESO=C(c1ccc(Nc2nccc3[nH]c(-c4c(Cl)cccc4Cl)nc23)nn1)N1CCOCC1
InChIInChI=1S/C21H17Cl2N7O2/c22-12-2-1-3-13(23)17(12)19-25-14-6-7-24-20(18(14)27-19)26-16-5-4-15(28-29-16)21(31)30-8-10-32-11-9-30/h1-7H,8-11H2,(H,25,27)(H,24,26,29)
InChIKeyIEYFPEHMQDEDSW-UHFFFAOYSA-N
MW470.32 g/mol
LogP3.94
Rot. Bonds4

About [6-[[2-(2,6-dichlorophenyl)-1H-imidazo[4,5-c]pyridin-4-yl]amino]pyridazin-3-yl]-morpholin-4-ylmethanone

[6-[[2-(2,6-dichlorophenyl)-1H-imidazo[4,5-c]pyridin-4-yl]amino]pyridazin-3-yl]-morpholin-4-ylmethanone (PubChem CID 67388554) has the molecular formula C21H17Cl2N7O2 and a molecular weight of 470.32 g/mol. Its IUPAC name is [6-[[2-(2,6-dichlorophenyl)-1H-imidazo[4,5-c]pyridin-4-yl]amino]pyridazin-3-yl]-morpholin-4-ylmethanone.

Molecular Properties

Compound Name[6-[[2-(2,6-dichlorophenyl)-1H-imidazo[4,5-c]pyridin-4-yl]amino]pyridazin-3-yl]-morpholin-4-ylmethanone
PubChem CID67388554
Molecular FormulaC21H17Cl2N7O2
Molecular Weight470.32 g/mol
Exact Mass469.08
IUPAC Name[6-[[2-(2,6-dichlorophenyl)-1H-imidazo[4,5-c]pyridin-4-yl]amino]pyridazin-3-yl]-morpholin-4-ylmethanone
SMILESO=C(c1ccc(Nc2nccc3[nH]c(-c4c(Cl)cccc4Cl)nc23)nn1)N1CCOCC1
InChIInChI=1S/C21H17Cl2N7O2/c22-12-2-1-3-13(23)17(12)19-25-14-6-7-24-20(18(14)27-19)26-16-5-4-15(28-29-16)21(31)30-8-10-32-11-9-30/h1-7H,8-11H2,(H,25,27)(H,24,26,29)
InChIKeyIEYFPEHMQDEDSW-UHFFFAOYSA-N
XLogP3.94
TPSA108.92 Ų
H-Bond Donors2
H-Bond Acceptors7
Rotatable Bonds4
Heavy Atoms32
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500470.32
LogP ≤ 53.94
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 107

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Related Compounds

2-(2-chloro-6-fluorophenyl)-N-(6-morpholin-4-ylpyrimidin-4-yl)-1H-imidazo[4,5-c]pyridin-4-amine
CID 67388176
6-[[2-(2,6-dichlorophenyl)-1H-imidazo[4,5-c]pyridin-4-yl]amino]-N-methylpyrimidine-4-carboxamide
CID 67383833
[6-(2-chloroanilino)pyridazin-3-yl]-pyrrolidin-1-ylmethanone
CID 109111996
[6-(methylamino)pyridazin-3-yl]-morpholin-4-ylmethanone
CID 62172695
[4-(2,6-dichloroanilino)-2-pyridinyl]-morpholin-4-ylmethanone
CID 109206553
morpholin-4-yl-[6-[2-(trifluoromethyl)anilino]pyridazin-3-yl]methanone
CID 109114740
morpholin-4-yl-[6-(2-propan-2-ylanilino)pyridazin-3-yl]methanone
CID 109114707
2-(2,6-dichlorophenyl)-N-(2,5-dimethylpyrazol-3-yl)-1H-imidazo[4,5-c]pyridin-4-amine
CID 67388167
[6-(cyclohexylamino)pyridazin-3-yl]-morpholin-4-ylmethanone
CID 109112814
[6-(4-bromoanilino)pyridazin-3-yl]-morpholin-4-ylmethanone
CID 109114727
1-[3-[[6-(morpholine-4-carbonyl)pyridazin-3-yl]amino]phenyl]ethanone
CID 109114743
[6-(2,3-dichloroanilino)pyridazin-3-yl]-(4-methylpiperazin-1-yl)methanone
CID 109116455

Frequently Asked Questions

What is the IUPAC name of [6-[[2-(2,6-dichlorophenyl)-1H-imidazo[4,5-c]pyridin-4-yl]amino]pyridazin-3-yl]-morpholin-4-ylmethanone?
The IUPAC name of [6-[[2-(2,6-dichlorophenyl)-1H-imidazo[4,5-c]pyridin-4-yl]amino]pyridazin-3-yl]-morpholin-4-ylmethanone (CID 67388554) is [6-[[2-(2,6-dichlorophenyl)-1H-imidazo[4,5-c]pyridin-4-yl]amino]pyridazin-3-yl]-morpholin-4-ylmethanone.
What is the SMILES notation for [6-[[2-(2,6-dichlorophenyl)-1H-imidazo[4,5-c]pyridin-4-yl]amino]pyridazin-3-yl]-morpholin-4-ylmethanone?
The canonical SMILES for [6-[[2-(2,6-dichlorophenyl)-1H-imidazo[4,5-c]pyridin-4-yl]amino]pyridazin-3-yl]-morpholin-4-ylmethanone is O=C(c1ccc(Nc2nccc3[nH]c(-c4c(Cl)cccc4Cl)nc23)nn1)N1CCOCC1.
What is the InChIKey of [6-[[2-(2,6-dichlorophenyl)-1H-imidazo[4,5-c]pyridin-4-yl]amino]pyridazin-3-yl]-morpholin-4-ylmethanone?
The InChIKey is IEYFPEHMQDEDSW-UHFFFAOYSA-N. The full InChI is InChI=1S/C21H17Cl2N7O2/c22-12-2-1-3-13(23)17(12)19-25-14-6-7-24-20(18(14)27-19)26-16-5-4-15(28-29-16)21(31)30-8-10-32-11-9-30/h1-7H,8-11H2,(H,25,27)(H,24,26,29).
What are the key properties of [6-[[2-(2,6-dichlorophenyl)-1H-imidazo[4,5-c]pyridin-4-yl]amino]pyridazin-3-yl]-morpholin-4-ylmethanone?
[6-[[2-(2,6-dichlorophenyl)-1H-imidazo[4,5-c]pyridin-4-yl]amino]pyridazin-3-yl]-morpholin-4-ylmethanone has a molecular weight of 470.32 g/mol, XLogP of 3.94, 4 rotatable bonds, 2 hydrogen bond donors, and 7 hydrogen bond acceptors.
Where does this data come from?
All data for [6-[[2-(2,6-dichlorophenyl)-1H-imidazo[4,5-c]pyridin-4-yl]amino]pyridazin-3-yl]-morpholin-4-ylmethanone is sourced from PubChem (CID 67388554), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).