5-(1-methylindol-3-yl)-1,3-oxazol-2-amine

C12H11N3O — CID 82284357

IUPAC5-(1-methylindol-3-yl)-1,3-oxazol-2-amine
SMILESCn1cc(-c2cnc(N)o2)c2ccccc21
InChIInChI=1S/C12H11N3O/c1-15-7-9(11-6-14-12(13)16-11)8-4-2-3-5-10(8)15/h2-7H,1H3,(H2,13,14)
InChIKeyURIYQYWPVNJBFP-UHFFFAOYSA-N
MW213.24 g/mol
LogP2.42
Rot. Bonds1

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

5-(1-methylindol-3-yl)-1,3-oxazol-2-amine (PubChem CID 82284357) has the molecular formula C12H11N3O and a molecular weight of 213.24 g/mol. Its IUPAC name is 5-(1-methylindol-3-yl)-1,3-oxazol-2-amine.

Molecular Properties

Compound Name5-(1-methylindol-3-yl)-1,3-oxazol-2-amine
PubChem CID82284357
Molecular FormulaC12H11N3O
Molecular Weight213.24 g/mol
Exact Mass213.09
IUPAC Name5-(1-methylindol-3-yl)-1,3-oxazol-2-amine
SMILESCn1cc(-c2cnc(N)o2)c2ccccc21
InChIInChI=1S/C12H11N3O/c1-15-7-9(11-6-14-12(13)16-11)8-4-2-3-5-10(8)15/h2-7H,1H3,(H2,13,14)
InChIKeyURIYQYWPVNJBFP-UHFFFAOYSA-N
XLogP2.42
TPSA56.98 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds1
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500213.24
LogP ≤ 52.42
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of 5-(1-methylindol-3-yl)-1,3-oxazol-2-amine?
The IUPAC name of 5-(1-methylindol-3-yl)-1,3-oxazol-2-amine (CID 82284357) is 5-(1-methylindol-3-yl)-1,3-oxazol-2-amine.
What is the SMILES notation for 5-(1-methylindol-3-yl)-1,3-oxazol-2-amine?
The canonical SMILES for 5-(1-methylindol-3-yl)-1,3-oxazol-2-amine is Cn1cc(-c2cnc(N)o2)c2ccccc21.
What is the InChIKey of 5-(1-methylindol-3-yl)-1,3-oxazol-2-amine?
The InChIKey is URIYQYWPVNJBFP-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H11N3O/c1-15-7-9(11-6-14-12(13)16-11)8-4-2-3-5-10(8)15/h2-7H,1H3,(H2,13,14).
What are the key properties of 5-(1-methylindol-3-yl)-1,3-oxazol-2-amine?
5-(1-methylindol-3-yl)-1,3-oxazol-2-amine has a molecular weight of 213.24 g/mol, XLogP of 2.42, 1 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 5-(1-methylindol-3-yl)-1,3-oxazol-2-amine is sourced from PubChem (CID 82284357), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).