2-[6-methoxy-2-(oxan-4-yl)indazol-5-yl]-1-(6-morpholin-4-yl-2-pyridinyl)ethanone

C24H28N4O4 — CID 161198224

IUPAC2-[6-methoxy-2-(oxan-4-yl)indazol-5-yl]-1-(6-morpholin-4-yl-2-pyridinyl)ethanone
SMILESCOc1cc2nn(C3CCOCC3)cc2cc1CC(=O)c1cccc(N2CCOCC2)n1
InChIInChI=1S/C24H28N4O4/c1-30-23-15-21-18(16-28(26-21)19-5-9-31-10-6-19)13-17(23)14-22(29)20-3-2-4-24(25-20)27-7-11-32-12-8-27/h2-4,13,15-16,19H,5-12,14H2,1H3
InChIKeyUUQDQZLDTWPCOS-UHFFFAOYSA-N
MW436.51 g/mol
LogP3.05
Rot. Bonds6

About 2-[6-methoxy-2-(oxan-4-yl)indazol-5-yl]-1-(6-morpholin-4-yl-2-pyridinyl)ethanone

2-[6-methoxy-2-(oxan-4-yl)indazol-5-yl]-1-(6-morpholin-4-yl-2-pyridinyl)ethanone (PubChem CID 161198224) has the molecular formula C24H28N4O4 and a molecular weight of 436.51 g/mol. Its IUPAC name is 2-[6-methoxy-2-(oxan-4-yl)indazol-5-yl]-1-(6-morpholin-4-yl-2-pyridinyl)ethanone.

Molecular Properties

Compound Name2-[6-methoxy-2-(oxan-4-yl)indazol-5-yl]-1-(6-morpholin-4-yl-2-pyridinyl)ethanone
PubChem CID161198224
Molecular FormulaC24H28N4O4
Molecular Weight436.51 g/mol
Exact Mass436.21
IUPAC Name2-[6-methoxy-2-(oxan-4-yl)indazol-5-yl]-1-(6-morpholin-4-yl-2-pyridinyl)ethanone
SMILESCOc1cc2nn(C3CCOCC3)cc2cc1CC(=O)c1cccc(N2CCOCC2)n1
InChIInChI=1S/C24H28N4O4/c1-30-23-15-21-18(16-28(26-21)19-5-9-31-10-6-19)13-17(23)14-22(29)20-3-2-4-24(25-20)27-7-11-32-12-8-27/h2-4,13,15-16,19H,5-12,14H2,1H3
InChIKeyUUQDQZLDTWPCOS-UHFFFAOYSA-N
XLogP3.05
TPSA78.71 Ų
H-Bond Donors
H-Bond Acceptors8
Rotatable Bonds6
Heavy Atoms32
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500436.51
LogP ≤ 53.05
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 108

Analyze 2-[6-methoxy-2-(oxan-4-yl)indazol-5-yl]-1-(6-morpholin-4-yl-2-pyridinyl)ethanone with MolForge

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Related Compounds

2-[6-methoxy-2-[1-(oxetan-3-yl)piperidin-4-yl]indazol-5-yl]-1-[6-(trifluoromethyl)-2-pyridinyl]ethanone
CID 147444182
2-(6-methoxy-2-piperidin-4-ylindazol-5-yl)-1-[6-(trifluoromethyl)-2-pyridinyl]ethanone
CID 158482410
6-(2-hydroxypropan-2-yl)-N-[6-methoxy-2-(oxan-4-yl)indazol-5-yl]pyridine-2-carboxamide
CID 137377513
2-[6-methoxy-2-(2-morpholin-4-yl-2-oxoethyl)indazol-5-yl]-1-[6-(2,2,2-trifluoro-1-hydroxyethyl)-2-pyridinyl]ethanone
CID 147437195
2-[2-[(1S,4S,5R)-2-azabicyclo[2.2.1]heptan-5-yl]-6-methoxyindazol-5-yl]-1-[6-(trifluoromethyl)-2-pyridinyl]ethanone
CID 161138298
methyl 6-[(4-methoxyphenyl)methoxy]-2-(oxan-4-yl)indazole-5-carboxylate
CID 155438450
N-[6-(difluoromethyl)-2-pyridinyl]-6-methoxy-2-(oxan-4-yl)indazole-5-carboxamide;hydrochloride
CID 155438577
N-(3,4-dimethoxyphenyl)-6-morpholin-4-ylpyridine-2-carboxamide
CID 84573864
2-[5-[2-(6-bromo-2-pyridinyl)-2-oxoethyl]-6-methoxyindazol-2-yl]acetic acid
CID 149455991
methyl 2-(oxan-4-yl)indazole-6-carboxylate
CID 137377490
2-[2-[2-[4-(2-hydroxypropan-2-yl)piperidin-1-yl]-2-oxoethyl]-6-methoxyindazol-5-yl]-1-[6-(trifluoromethyl)-2-pyridinyl]ethanone
CID 158362016
N-(2-methoxyphenyl)-6-morpholin-4-ylpyridine-2-carboxamide
CID 84573867

Frequently Asked Questions

What is the IUPAC name of 2-[6-methoxy-2-(oxan-4-yl)indazol-5-yl]-1-(6-morpholin-4-yl-2-pyridinyl)ethanone?
The IUPAC name of 2-[6-methoxy-2-(oxan-4-yl)indazol-5-yl]-1-(6-morpholin-4-yl-2-pyridinyl)ethanone (CID 161198224) is 2-[6-methoxy-2-(oxan-4-yl)indazol-5-yl]-1-(6-morpholin-4-yl-2-pyridinyl)ethanone.
What is the SMILES notation for 2-[6-methoxy-2-(oxan-4-yl)indazol-5-yl]-1-(6-morpholin-4-yl-2-pyridinyl)ethanone?
The canonical SMILES for 2-[6-methoxy-2-(oxan-4-yl)indazol-5-yl]-1-(6-morpholin-4-yl-2-pyridinyl)ethanone is COc1cc2nn(C3CCOCC3)cc2cc1CC(=O)c1cccc(N2CCOCC2)n1.
What is the InChIKey of 2-[6-methoxy-2-(oxan-4-yl)indazol-5-yl]-1-(6-morpholin-4-yl-2-pyridinyl)ethanone?
The InChIKey is UUQDQZLDTWPCOS-UHFFFAOYSA-N. The full InChI is InChI=1S/C24H28N4O4/c1-30-23-15-21-18(16-28(26-21)19-5-9-31-10-6-19)13-17(23)14-22(29)20-3-2-4-24(25-20)27-7-11-32-12-8-27/h2-4,13,15-16,19H,5-12,14H2,1H3.
What are the key properties of 2-[6-methoxy-2-(oxan-4-yl)indazol-5-yl]-1-(6-morpholin-4-yl-2-pyridinyl)ethanone?
2-[6-methoxy-2-(oxan-4-yl)indazol-5-yl]-1-(6-morpholin-4-yl-2-pyridinyl)ethanone has a molecular weight of 436.51 g/mol, XLogP of 3.05, 6 rotatable bonds, 0 hydrogen bond donors, and 8 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[6-methoxy-2-(oxan-4-yl)indazol-5-yl]-1-(6-morpholin-4-yl-2-pyridinyl)ethanone is sourced from PubChem (CID 161198224), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).