2-methyl-6-(6-methyl-5-propan-2-yloxy-1H-indazol-3-yl)-4-morpholin-4-ylpyridazin-3-one

C20H25N5O3 — CID 169236508

IUPAC2-methyl-6-(6-methyl-5-propan-2-yloxy-1H-indazol-3-yl)-4-morpholin-4-ylpyridazin-3-one
SMILESCc1cc2[nH]nc(-c3cc(N4CCOCC4)c(=O)n(C)n3)c2cc1OC(C)C
InChIInChI=1S/C20H25N5O3/c1-12(2)28-18-10-14-15(9-13(18)3)21-22-19(14)16-11-17(20(26)24(4)23-16)25-5-7-27-8-6-25/h9-12H,5-8H2,1-4H3,(H,21,22)
InChIKeyHJVJHLFBPUKABJ-UHFFFAOYSA-N
MW383.45 g/mol
LogP2.26
Rot. Bonds4

About 2-methyl-6-(6-methyl-5-propan-2-yloxy-1H-indazol-3-yl)-4-morpholin-4-ylpyridazin-3-one

2-methyl-6-(6-methyl-5-propan-2-yloxy-1H-indazol-3-yl)-4-morpholin-4-ylpyridazin-3-one (PubChem CID 169236508) has the molecular formula C20H25N5O3 and a molecular weight of 383.45 g/mol. Its IUPAC name is 2-methyl-6-(6-methyl-5-propan-2-yloxy-1H-indazol-3-yl)-4-morpholin-4-ylpyridazin-3-one.

Molecular Properties

Compound Name2-methyl-6-(6-methyl-5-propan-2-yloxy-1H-indazol-3-yl)-4-morpholin-4-ylpyridazin-3-one
PubChem CID169236508
Molecular FormulaC20H25N5O3
Molecular Weight383.45 g/mol
Exact Mass383.20
IUPAC Name2-methyl-6-(6-methyl-5-propan-2-yloxy-1H-indazol-3-yl)-4-morpholin-4-ylpyridazin-3-one
SMILESCc1cc2[nH]nc(-c3cc(N4CCOCC4)c(=O)n(C)n3)c2cc1OC(C)C
InChIInChI=1S/C20H25N5O3/c1-12(2)28-18-10-14-15(9-13(18)3)21-22-19(14)16-11-17(20(26)24(4)23-16)25-5-7-27-8-6-25/h9-12H,5-8H2,1-4H3,(H,21,22)
InChIKeyHJVJHLFBPUKABJ-UHFFFAOYSA-N
XLogP2.26
TPSA85.27 Ų
H-Bond Donors1
H-Bond Acceptors7
Rotatable Bonds4
Heavy Atoms28
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500383.45
LogP ≤ 52.26
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 107

Analyze 2-methyl-6-(6-methyl-5-propan-2-yloxy-1H-indazol-3-yl)-4-morpholin-4-ylpyridazin-3-one with MolForge

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Related Compounds

2-methyl-4-morpholin-4-yl-6-(1,6,7,8-tetrahydropyrano[2,3-f]indazol-3-yl)pyridazin-3-one
CID 169236294
2-methyl-2-[1-(1-methyl-5-morpholin-4-yl-6-oxopyridazin-3-yl)-4-[3-(1-methyl-6-oxo-5-pyrrolidin-1-ylpyridazin-3-yl)-5-propan-2-yloxy-1H-indazol-6-yl]indazol-6-yl]propanenitrile
CID 169236310
4-morpholin-4-yl-6-(5-propan-2-yloxy-1H-indazol-3-yl)-2-(trifluoromethyl)pyridazin-3-one
CID 169236234
6-(1-iodophosphanyl-4-methyl-5-propan-2-yloxyindazol-3-yl)-2-methyl-4-morpholin-4-ylpyridazin-3-one
CID 169236305
4-[butyl(2-hydroxyethyl)amino]-2-methyl-6-(4-methyl-5-propan-2-yloxy-1H-indazol-3-yl)pyridazin-3-one;2-methyl-6-[5-[(2-methylpropan-2-yl)oxy]-1H-indazol-3-yl]-4-morpholin-4-ylpyridazin-3-one
CID 169236429
4-[(7R)-7-(hydroxymethyl)-1,4-oxazepan-4-yl]-2-methyl-6-[5-(1-methylcyclopropyl)oxy-1H-indazol-3-yl]pyridazin-3-one
CID 169236529
6-[5-cyclopropyloxy-1-(oxan-2-yl)indazol-3-yl]-2-methyl-4-morpholin-4-ylpyridazin-3-one
CID 169236415
4-(2,2-dimethyl-1,4-oxazepan-4-yl)-2-methyl-6-[5-(1-methylcyclopropyl)oxy-1H-indazol-3-yl]pyridazin-3-one
CID 169236499
4-(2,3,3a,5,6,6a-hexahydrofuro[3,2-b]pyrrol-4-yl)-2-methyl-6-[5-(1-methylcyclopropyl)oxy-1H-indazol-3-yl]pyridazin-3-one
CID 169236283
N-methylmethanamine;4-morpholin-4-yl-6-propan-2-yloxy-1H-indole-2-carboxylic acid
CID 175136889
N-[4-methyl-3-(1-methyl-5-morpholin-4-yl-6-oxopyridazin-3-yl)phenyl]-2-(oxetan-3-yl)pyridine-4-carboxamide
CID 90456439
ethane;6-[1-iodophosphanyl-5-(trifluoromethoxy)indazol-3-yl]-2-methyl-4-morpholin-4-ylpyridazin-3-one
CID 169236469

Frequently Asked Questions

What is the IUPAC name of 2-methyl-6-(6-methyl-5-propan-2-yloxy-1H-indazol-3-yl)-4-morpholin-4-ylpyridazin-3-one?
The IUPAC name of 2-methyl-6-(6-methyl-5-propan-2-yloxy-1H-indazol-3-yl)-4-morpholin-4-ylpyridazin-3-one (CID 169236508) is 2-methyl-6-(6-methyl-5-propan-2-yloxy-1H-indazol-3-yl)-4-morpholin-4-ylpyridazin-3-one.
What is the SMILES notation for 2-methyl-6-(6-methyl-5-propan-2-yloxy-1H-indazol-3-yl)-4-morpholin-4-ylpyridazin-3-one?
The canonical SMILES for 2-methyl-6-(6-methyl-5-propan-2-yloxy-1H-indazol-3-yl)-4-morpholin-4-ylpyridazin-3-one is Cc1cc2[nH]nc(-c3cc(N4CCOCC4)c(=O)n(C)n3)c2cc1OC(C)C.
What is the InChIKey of 2-methyl-6-(6-methyl-5-propan-2-yloxy-1H-indazol-3-yl)-4-morpholin-4-ylpyridazin-3-one?
The InChIKey is HJVJHLFBPUKABJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H25N5O3/c1-12(2)28-18-10-14-15(9-13(18)3)21-22-19(14)16-11-17(20(26)24(4)23-16)25-5-7-27-8-6-25/h9-12H,5-8H2,1-4H3,(H,21,22).
What are the key properties of 2-methyl-6-(6-methyl-5-propan-2-yloxy-1H-indazol-3-yl)-4-morpholin-4-ylpyridazin-3-one?
2-methyl-6-(6-methyl-5-propan-2-yloxy-1H-indazol-3-yl)-4-morpholin-4-ylpyridazin-3-one has a molecular weight of 383.45 g/mol, XLogP of 2.26, 4 rotatable bonds, 1 hydrogen bond donors, and 7 hydrogen bond acceptors.
Where does this data come from?
All data for 2-methyl-6-(6-methyl-5-propan-2-yloxy-1H-indazol-3-yl)-4-morpholin-4-ylpyridazin-3-one is sourced from PubChem (CID 169236508), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).