3-[3-(5-methoxy-1H-indol-2-yl)-1H-indazol-5-yl]-1,3-oxazolidin-2-one

C19H16N4O3 — CID 155316600

IUPAC3-[3-(5-methoxy-1H-indol-2-yl)-1H-indazol-5-yl]-1,3-oxazolidin-2-one
SMILESCOc1ccc2[nH]c(-c3n[nH]c4ccc(N5CCOC5=O)cc34)cc2c1
InChIInChI=1S/C19H16N4O3/c1-25-13-3-5-15-11(8-13)9-17(20-15)18-14-10-12(2-4-16(14)21-22-18)23-6-7-26-19(23)24/h2-5,8-10,20H,6-7H2,1H3,(H,21,22)
InChIKeyDCLOQKLWFYDYED-UHFFFAOYSA-N
MW348.36 g/mol
LogP3.68
Rot. Bonds3

About 3-[3-(5-methoxy-1H-indol-2-yl)-1H-indazol-5-yl]-1,3-oxazolidin-2-one

3-[3-(5-methoxy-1H-indol-2-yl)-1H-indazol-5-yl]-1,3-oxazolidin-2-one (PubChem CID 155316600) has the molecular formula C19H16N4O3 and a molecular weight of 348.36 g/mol. Its IUPAC name is 3-[3-(5-methoxy-1H-indol-2-yl)-1H-indazol-5-yl]-1,3-oxazolidin-2-one.

Molecular Properties

Compound Name3-[3-(5-methoxy-1H-indol-2-yl)-1H-indazol-5-yl]-1,3-oxazolidin-2-one
PubChem CID155316600
Molecular FormulaC19H16N4O3
Molecular Weight348.36 g/mol
Exact Mass348.12
IUPAC Name3-[3-(5-methoxy-1H-indol-2-yl)-1H-indazol-5-yl]-1,3-oxazolidin-2-one
SMILESCOc1ccc2[nH]c(-c3n[nH]c4ccc(N5CCOC5=O)cc34)cc2c1
InChIInChI=1S/C19H16N4O3/c1-25-13-3-5-15-11(8-13)9-17(20-15)18-14-10-12(2-4-16(14)21-22-18)23-6-7-26-19(23)24/h2-5,8-10,20H,6-7H2,1H3,(H,21,22)
InChIKeyDCLOQKLWFYDYED-UHFFFAOYSA-N
XLogP3.68
TPSA83.24 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms26
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500348.36
LogP ≤ 53.68
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of 3-[3-(5-methoxy-1H-indol-2-yl)-1H-indazol-5-yl]-1,3-oxazolidin-2-one?
The IUPAC name of 3-[3-(5-methoxy-1H-indol-2-yl)-1H-indazol-5-yl]-1,3-oxazolidin-2-one (CID 155316600) is 3-[3-(5-methoxy-1H-indol-2-yl)-1H-indazol-5-yl]-1,3-oxazolidin-2-one.
What is the SMILES notation for 3-[3-(5-methoxy-1H-indol-2-yl)-1H-indazol-5-yl]-1,3-oxazolidin-2-one?
The canonical SMILES for 3-[3-(5-methoxy-1H-indol-2-yl)-1H-indazol-5-yl]-1,3-oxazolidin-2-one is COc1ccc2[nH]c(-c3n[nH]c4ccc(N5CCOC5=O)cc34)cc2c1.
What is the InChIKey of 3-[3-(5-methoxy-1H-indol-2-yl)-1H-indazol-5-yl]-1,3-oxazolidin-2-one?
The InChIKey is DCLOQKLWFYDYED-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H16N4O3/c1-25-13-3-5-15-11(8-13)9-17(20-15)18-14-10-12(2-4-16(14)21-22-18)23-6-7-26-19(23)24/h2-5,8-10,20H,6-7H2,1H3,(H,21,22).
What are the key properties of 3-[3-(5-methoxy-1H-indol-2-yl)-1H-indazol-5-yl]-1,3-oxazolidin-2-one?
3-[3-(5-methoxy-1H-indol-2-yl)-1H-indazol-5-yl]-1,3-oxazolidin-2-one has a molecular weight of 348.36 g/mol, XLogP of 3.68, 3 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 3-[3-(5-methoxy-1H-indol-2-yl)-1H-indazol-5-yl]-1,3-oxazolidin-2-one is sourced from PubChem (CID 155316600), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).