4-[[1-(3,5-dimethyl-1,2-oxazol-4-yl)indazol-3-yl]methyl]morpholine

C17H20N4O2 — CID 137499082

IUPAC4-[[1-(3,5-dimethyl-1,2-oxazol-4-yl)indazol-3-yl]methyl]morpholine
SMILESCc1noc(C)c1-n1nc(CN2CCOCC2)c2ccccc21
InChIInChI=1S/C17H20N4O2/c1-12-17(13(2)23-19-12)21-16-6-4-3-5-14(16)15(18-21)11-20-7-9-22-10-8-20/h3-6H,7-11H2,1-2H3
InChIKeyZQQIUEAELISYDP-UHFFFAOYSA-N
MW312.37 g/mol
LogP2.46
Rot. Bonds3

About 4-[[1-(3,5-dimethyl-1,2-oxazol-4-yl)indazol-3-yl]methyl]morpholine

4-[[1-(3,5-dimethyl-1,2-oxazol-4-yl)indazol-3-yl]methyl]morpholine (PubChem CID 137499082) has the molecular formula C17H20N4O2 and a molecular weight of 312.37 g/mol. Its IUPAC name is 4-[[1-(3,5-dimethyl-1,2-oxazol-4-yl)indazol-3-yl]methyl]morpholine.

Molecular Properties

Compound Name4-[[1-(3,5-dimethyl-1,2-oxazol-4-yl)indazol-3-yl]methyl]morpholine
PubChem CID137499082
Molecular FormulaC17H20N4O2
Molecular Weight312.37 g/mol
Exact Mass312.16
IUPAC Name4-[[1-(3,5-dimethyl-1,2-oxazol-4-yl)indazol-3-yl]methyl]morpholine
SMILESCc1noc(C)c1-n1nc(CN2CCOCC2)c2ccccc21
InChIInChI=1S/C17H20N4O2/c1-12-17(13(2)23-19-12)21-16-6-4-3-5-14(16)15(18-21)11-20-7-9-22-10-8-20/h3-6H,7-11H2,1-2H3
InChIKeyZQQIUEAELISYDP-UHFFFAOYSA-N
XLogP2.46
TPSA56.32 Ų
H-Bond Donors
H-Bond Acceptors6
Rotatable Bonds3
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500312.37
LogP ≤ 52.46
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 106

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Related Compounds

4-[(1-methylindol-3-yl)methyl]morpholine
CID 15496284
2-(3,5-dimethyl-1,2-oxazol-4-yl)-N-[[2-(morpholin-4-ylmethyl)phenyl]methyl]acetamide
CID 31787549
4-[[7-methyl-1-(2-methylpropyl)indazol-3-yl]methyl]morpholine
CID 151382459
4-[[1-[(5-methyl-2-naphthalen-1-yl-1,3-oxazol-4-yl)methyl]piperidin-4-yl]methyl]morpholine
CID 29259202
ethyl 1-(morpholin-4-ylmethyl)imidazo[1,5-a]pyridine-3-carboxylate
CID 57436228
N-[(1-methylindazol-3-yl)methyl]-1-morpholin-4-ylpropan-2-amine
CID 63000817
4-[(3,5-dimethyl-1,2-oxazol-4-yl)methyl]-2-phenylmorpholine
CID 51076931
4-[(5-methylpyrido[4,3-b]indol-3-yl)methyl]morpholine
CID 13316106
4-[[5-methyl-2-(3-methylphenyl)-1,3-oxazol-4-yl]methyl]morpholine
CID 30851824
ethane;4-[(2-methylphenyl)methyl]morpholine
CID 142083627
4-[(2-methylbenzimidazol-1-yl)methyl]morpholine
CID 3600029
5-(3,5-dimethyl-1,2-oxazol-4-yl)-2-[3-[(2,3,6-trifluorophenyl)methyl]indazol-1-yl]pyrimidine-4,6-diamine
CID 67408018

Frequently Asked Questions

What is the IUPAC name of 4-[[1-(3,5-dimethyl-1,2-oxazol-4-yl)indazol-3-yl]methyl]morpholine?
The IUPAC name of 4-[[1-(3,5-dimethyl-1,2-oxazol-4-yl)indazol-3-yl]methyl]morpholine (CID 137499082) is 4-[[1-(3,5-dimethyl-1,2-oxazol-4-yl)indazol-3-yl]methyl]morpholine.
What is the SMILES notation for 4-[[1-(3,5-dimethyl-1,2-oxazol-4-yl)indazol-3-yl]methyl]morpholine?
The canonical SMILES for 4-[[1-(3,5-dimethyl-1,2-oxazol-4-yl)indazol-3-yl]methyl]morpholine is Cc1noc(C)c1-n1nc(CN2CCOCC2)c2ccccc21.
What is the InChIKey of 4-[[1-(3,5-dimethyl-1,2-oxazol-4-yl)indazol-3-yl]methyl]morpholine?
The InChIKey is ZQQIUEAELISYDP-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H20N4O2/c1-12-17(13(2)23-19-12)21-16-6-4-3-5-14(16)15(18-21)11-20-7-9-22-10-8-20/h3-6H,7-11H2,1-2H3.
What are the key properties of 4-[[1-(3,5-dimethyl-1,2-oxazol-4-yl)indazol-3-yl]methyl]morpholine?
4-[[1-(3,5-dimethyl-1,2-oxazol-4-yl)indazol-3-yl]methyl]morpholine has a molecular weight of 312.37 g/mol, XLogP of 2.46, 3 rotatable bonds, 0 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 4-[[1-(3,5-dimethyl-1,2-oxazol-4-yl)indazol-3-yl]methyl]morpholine is sourced from PubChem (CID 137499082), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).