5-(5-ethyl-1,2-dimethylindol-3-yl)-1,2-oxazol-3-amine

C15H17N3O — CID 84742247

IUPAC5-(5-ethyl-1,2-dimethylindol-3-yl)-1,2-oxazol-3-amine
SMILESCCc1ccc2c(c1)c(-c1cc(N)no1)c(C)n2C
InChIInChI=1S/C15H17N3O/c1-4-10-5-6-12-11(7-10)15(9(2)18(12)3)13-8-14(16)17-19-13/h5-8H,4H2,1-3H3,(H2,16,17)
InChIKeyWQXSREZPLHGLOV-UHFFFAOYSA-N
MW255.32 g/mol
LogP3.29
Rot. Bonds2

About 5-(5-ethyl-1,2-dimethylindol-3-yl)-1,2-oxazol-3-amine

5-(5-ethyl-1,2-dimethylindol-3-yl)-1,2-oxazol-3-amine (PubChem CID 84742247) has the molecular formula C15H17N3O and a molecular weight of 255.32 g/mol. Its IUPAC name is 5-(5-ethyl-1,2-dimethylindol-3-yl)-1,2-oxazol-3-amine.

Molecular Properties

Compound Name5-(5-ethyl-1,2-dimethylindol-3-yl)-1,2-oxazol-3-amine
PubChem CID84742247
Molecular FormulaC15H17N3O
Molecular Weight255.32 g/mol
Exact Mass255.14
IUPAC Name5-(5-ethyl-1,2-dimethylindol-3-yl)-1,2-oxazol-3-amine
SMILESCCc1ccc2c(c1)c(-c1cc(N)no1)c(C)n2C
InChIInChI=1S/C15H17N3O/c1-4-10-5-6-12-11(7-10)15(9(2)18(12)3)13-8-14(16)17-19-13/h5-8H,4H2,1-3H3,(H2,16,17)
InChIKeyWQXSREZPLHGLOV-UHFFFAOYSA-N
XLogP3.29
TPSA56.98 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds2
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500255.32
LogP ≤ 53.29
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

5-(7-ethyl-1,2-dimethylindol-3-yl)-1,2-oxazol-3-amine
CID 84742263
2-(5-ethyl-1,2-dimethylindol-3-yl)propan-1-amine
CID 82495226
5-ethyl-1,2-dimethyl-3-(1,2,3,6-tetrahydropyridin-4-yl)indole
CID 84635404
5-ethyl-3-methyl-1,2-benzoxazole
CID 70293590
3-(5-tert-butyl-1,2-dimethylindol-3-yl)-1,2-oxazol-5-amine
CID 84743563
(E)-3-(5-ethyl-1,2-dimethylindol-3-yl)prop-2-enoic acid
CID 82497374
5-(5-fluoro-1-methylindol-2-yl)-1,2-oxazol-3-amine
CID 115108043
ethane;5-ethyl-1,2-benzoxazol-3-amine
CID 143324107
3-(3-amino-1,2-oxazol-5-yl)-5-ethylphenol
CID 117292492
8-ethyl-5-methyl-1,2,3,4-tetrahydropyrido[4,3-b]indole
CID 82492833
2-(3-amino-1,2-oxazol-5-yl)-3-fluoro-6-methylphenol
CID 136998720
5-(3-methylthiophen-2-yl)-1,2-oxazol-3-amine
CID 66199204

Frequently Asked Questions

What is the IUPAC name of 5-(5-ethyl-1,2-dimethylindol-3-yl)-1,2-oxazol-3-amine?
The IUPAC name of 5-(5-ethyl-1,2-dimethylindol-3-yl)-1,2-oxazol-3-amine (CID 84742247) is 5-(5-ethyl-1,2-dimethylindol-3-yl)-1,2-oxazol-3-amine.
What is the SMILES notation for 5-(5-ethyl-1,2-dimethylindol-3-yl)-1,2-oxazol-3-amine?
The canonical SMILES for 5-(5-ethyl-1,2-dimethylindol-3-yl)-1,2-oxazol-3-amine is CCc1ccc2c(c1)c(-c1cc(N)no1)c(C)n2C.
What is the InChIKey of 5-(5-ethyl-1,2-dimethylindol-3-yl)-1,2-oxazol-3-amine?
The InChIKey is WQXSREZPLHGLOV-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H17N3O/c1-4-10-5-6-12-11(7-10)15(9(2)18(12)3)13-8-14(16)17-19-13/h5-8H,4H2,1-3H3,(H2,16,17).
What are the key properties of 5-(5-ethyl-1,2-dimethylindol-3-yl)-1,2-oxazol-3-amine?
5-(5-ethyl-1,2-dimethylindol-3-yl)-1,2-oxazol-3-amine has a molecular weight of 255.32 g/mol, XLogP of 3.29, 2 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 5-(5-ethyl-1,2-dimethylindol-3-yl)-1,2-oxazol-3-amine is sourced from PubChem (CID 84742247), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).