[2-[[2-(4-methoxyphenyl)-5-methyl-1,3-oxazol-4-yl]methoxy]acetyl]azanide;rubidium(1+)

C14H15N2O4Rb — CID 145086248

IUPAC[2-[[2-(4-methoxyphenyl)-5-methyl-1,3-oxazol-4-yl]methoxy]acetyl]azanide;rubidium(1+)
SMILESCOc1ccc(-c2nc(COCC([NH-])=O)c(C)o2)cc1.[Rb+]
InChIInChI=1S/C14H16N2O4.Rb/c1-9-12(7-19-8-13(15)17)16-14(20-9)10-3-5-11(18-2)6-4-10;/h3-6H,7-8H2,1-2H3,(H2,15,17);/q;+1/p-1
InChIKeyNTADAWKIKLUFCV-UHFFFAOYSA-M
MW360.75 g/mol
LogP-0.24
Rot. Bonds6

About [2-[[2-(4-methoxyphenyl)-5-methyl-1,3-oxazol-4-yl]methoxy]acetyl]azanide;rubidium(1+)

[2-[[2-(4-methoxyphenyl)-5-methyl-1,3-oxazol-4-yl]methoxy]acetyl]azanide;rubidium(1+) (PubChem CID 145086248) has the molecular formula C14H15N2O4Rb and a molecular weight of 360.75 g/mol. Its IUPAC name is [2-[[2-(4-methoxyphenyl)-5-methyl-1,3-oxazol-4-yl]methoxy]acetyl]azanide;rubidium(1+).

Molecular Properties

Compound Name[2-[[2-(4-methoxyphenyl)-5-methyl-1,3-oxazol-4-yl]methoxy]acetyl]azanide;rubidium(1+)
PubChem CID145086248
Molecular FormulaC14H15N2O4Rb
Molecular Weight360.75 g/mol
Exact Mass360.01
IUPAC Name[2-[[2-(4-methoxyphenyl)-5-methyl-1,3-oxazol-4-yl]methoxy]acetyl]azanide;rubidium(1+)
SMILESCOc1ccc(-c2nc(COCC([NH-])=O)c(C)o2)cc1.[Rb+]
InChIInChI=1S/C14H16N2O4.Rb/c1-9-12(7-19-8-13(15)17)16-14(20-9)10-3-5-11(18-2)6-4-10;/h3-6H,7-8H2,1-2H3,(H2,15,17);/q;+1/p-1
InChIKeyNTADAWKIKLUFCV-UHFFFAOYSA-M
XLogP-0.24
TPSA85.36 Ų
H-Bond Donors
H-Bond Acceptors5
Rotatable Bonds6
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500360.75
LogP ≤ 5-0.24
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 105

Analyze [2-[[2-(4-methoxyphenyl)-5-methyl-1,3-oxazol-4-yl]methoxy]acetyl]azanide;rubidium(1+) with MolForge

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Related Compounds

[2-[[5-methyl-2-(4-methylphenyl)-1,3-oxazol-4-yl]methoxy]acetyl]azanide;rubidium(1+)
CID 145086257
4-(chloromethyl)-2-(4-methoxyphenyl)-5-methyl-1,3-oxazole
CID 14479955
2-[[5-methyl-2-(4-methylphenyl)-1,3-oxazol-4-yl]methoxy]-N-octylacetamide
CID 145086226
2-[2-(4-methoxyphenyl)-5-methyl-1,3-oxazol-4-yl]ethyl methanesulfonate
CID 22507101
(5-methyl-2-phenyl-1,3-oxazol-4-yl)methyl 2,4-dimethoxybenzoate
CID 16588780
N-[2-[2-(4-methoxyphenyl)-5-methyl-1,3-oxazol-4-yl]ethyl]benzamide
CID 110415241
[2-(4-methoxyphenyl)-5-methyl-1,3-oxazol-4-yl]methyl 5-methyl-1-(4-methylphenyl)triazole-4-carboxylate
CID 42585548
benzyl N-[2-[2-(4-methoxyphenyl)-5-methyl-1,3-oxazol-4-yl]ethyl]carbamate
CID 110415278
2,6-dimethoxy-N-[2-[2-(4-methoxyphenyl)-5-methyl-1,3-oxazol-4-yl]ethyl]benzamide
CID 110641191
[4-[4-(chloromethyl)-5-methyl-1,3-oxazol-2-yl]phenyl] acetate
CID 69217279
N-methyl-4-[5-methyl-4-[(4-methylphenoxy)methyl]-1,3-oxazol-2-yl]benzamide
CID 20916670
N-[3-(4-hydroxyphenyl)propyl]-2-[2-(4-methoxyphenyl)-5-methyl-1,3-oxazol-4-yl]acetamide
CID 110424249

Frequently Asked Questions

What is the IUPAC name of [2-[[2-(4-methoxyphenyl)-5-methyl-1,3-oxazol-4-yl]methoxy]acetyl]azanide;rubidium(1+)?
The IUPAC name of [2-[[2-(4-methoxyphenyl)-5-methyl-1,3-oxazol-4-yl]methoxy]acetyl]azanide;rubidium(1+) (CID 145086248) is [2-[[2-(4-methoxyphenyl)-5-methyl-1,3-oxazol-4-yl]methoxy]acetyl]azanide;rubidium(1+).
What is the SMILES notation for [2-[[2-(4-methoxyphenyl)-5-methyl-1,3-oxazol-4-yl]methoxy]acetyl]azanide;rubidium(1+)?
The canonical SMILES for [2-[[2-(4-methoxyphenyl)-5-methyl-1,3-oxazol-4-yl]methoxy]acetyl]azanide;rubidium(1+) is COc1ccc(-c2nc(COCC([NH-])=O)c(C)o2)cc1.[Rb+].
What is the InChIKey of [2-[[2-(4-methoxyphenyl)-5-methyl-1,3-oxazol-4-yl]methoxy]acetyl]azanide;rubidium(1+)?
The InChIKey is NTADAWKIKLUFCV-UHFFFAOYSA-M. The full InChI is InChI=1S/C14H16N2O4.Rb/c1-9-12(7-19-8-13(15)17)16-14(20-9)10-3-5-11(18-2)6-4-10;/h3-6H,7-8H2,1-2H3,(H2,15,17);/q;+1/p-1.
What are the key properties of [2-[[2-(4-methoxyphenyl)-5-methyl-1,3-oxazol-4-yl]methoxy]acetyl]azanide;rubidium(1+)?
[2-[[2-(4-methoxyphenyl)-5-methyl-1,3-oxazol-4-yl]methoxy]acetyl]azanide;rubidium(1+) has a molecular weight of 360.75 g/mol, XLogP of -0.24, 6 rotatable bonds, 0 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for [2-[[2-(4-methoxyphenyl)-5-methyl-1,3-oxazol-4-yl]methoxy]acetyl]azanide;rubidium(1+) is sourced from PubChem (CID 145086248), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).