3-(2H-indazol-3-yl)-N-(5-methyl-2-oxooxolan-3-yl)propanamide

C15H17N3O3 — CID 166259655

IUPAC3-(2H-indazol-3-yl)-N-(5-methyl-2-oxooxolan-3-yl)propanamide
SMILESCC1CC(NC(=O)CCc2[nH]nc3ccccc23)C(=O)O1
InChIInChI=1S/C15H17N3O3/c1-9-8-13(15(20)21-9)16-14(19)7-6-12-10-4-2-3-5-11(10)17-18-12/h2-5,9,13H,6-8H2,1H3,(H,16,19)(H,17,18)
InChIKeyUYQXGZOEIXVPSK-UHFFFAOYSA-N
MW287.32 g/mol
LogP1.32
Rot. Bonds4

About 3-(2H-indazol-3-yl)-N-(5-methyl-2-oxooxolan-3-yl)propanamide

3-(2H-indazol-3-yl)-N-(5-methyl-2-oxooxolan-3-yl)propanamide (PubChem CID 166259655) has the molecular formula C15H17N3O3 and a molecular weight of 287.32 g/mol. Its IUPAC name is 3-(2H-indazol-3-yl)-N-(5-methyl-2-oxooxolan-3-yl)propanamide.

Molecular Properties

Compound Name3-(2H-indazol-3-yl)-N-(5-methyl-2-oxooxolan-3-yl)propanamide
PubChem CID166259655
Molecular FormulaC15H17N3O3
Molecular Weight287.32 g/mol
Exact Mass287.13
IUPAC Name3-(2H-indazol-3-yl)-N-(5-methyl-2-oxooxolan-3-yl)propanamide
SMILESCC1CC(NC(=O)CCc2[nH]nc3ccccc23)C(=O)O1
InChIInChI=1S/C15H17N3O3/c1-9-8-13(15(20)21-9)16-14(19)7-6-12-10-4-2-3-5-11(10)17-18-12/h2-5,9,13H,6-8H2,1H3,(H,16,19)(H,17,18)
InChIKeyUYQXGZOEIXVPSK-UHFFFAOYSA-N
XLogP1.32
TPSA84.08 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500287.32
LogP ≤ 51.32
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of 3-(2H-indazol-3-yl)-N-(5-methyl-2-oxooxolan-3-yl)propanamide?
The IUPAC name of 3-(2H-indazol-3-yl)-N-(5-methyl-2-oxooxolan-3-yl)propanamide (CID 166259655) is 3-(2H-indazol-3-yl)-N-(5-methyl-2-oxooxolan-3-yl)propanamide.
What is the SMILES notation for 3-(2H-indazol-3-yl)-N-(5-methyl-2-oxooxolan-3-yl)propanamide?
The canonical SMILES for 3-(2H-indazol-3-yl)-N-(5-methyl-2-oxooxolan-3-yl)propanamide is CC1CC(NC(=O)CCc2[nH]nc3ccccc23)C(=O)O1.
What is the InChIKey of 3-(2H-indazol-3-yl)-N-(5-methyl-2-oxooxolan-3-yl)propanamide?
The InChIKey is UYQXGZOEIXVPSK-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H17N3O3/c1-9-8-13(15(20)21-9)16-14(19)7-6-12-10-4-2-3-5-11(10)17-18-12/h2-5,9,13H,6-8H2,1H3,(H,16,19)(H,17,18).
What are the key properties of 3-(2H-indazol-3-yl)-N-(5-methyl-2-oxooxolan-3-yl)propanamide?
3-(2H-indazol-3-yl)-N-(5-methyl-2-oxooxolan-3-yl)propanamide has a molecular weight of 287.32 g/mol, XLogP of 1.32, 4 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 3-(2H-indazol-3-yl)-N-(5-methyl-2-oxooxolan-3-yl)propanamide is sourced from PubChem (CID 166259655), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).