2-(5-methyl-1,2,4-oxadiazol-3-yl)-N-[1-(pyridine-3-carbonyl)-2,3-dihydroindol-5-yl]acetamide

C19H17N5O3 — CID 110623427

IUPAC2-(5-methyl-1,2,4-oxadiazol-3-yl)-N-[1-(pyridine-3-carbonyl)-2,3-dihydroindol-5-yl]acetamide
SMILESCc1nc(CC(=O)Nc2ccc3c(c2)CCN3C(=O)c2cccnc2)no1
InChIInChI=1S/C19H17N5O3/c1-12-21-17(23-27-12)10-18(25)22-15-4-5-16-13(9-15)6-8-24(16)19(26)14-3-2-7-20-11-14/h2-5,7,9,11H,6,8,10H2,1H3,(H,22,25)
InChIKeyQJGVZXQRBVDVRC-UHFFFAOYSA-N
MW363.38 g/mol
LogP2.16
Rot. Bonds4

About 2-(5-methyl-1,2,4-oxadiazol-3-yl)-N-[1-(pyridine-3-carbonyl)-2,3-dihydroindol-5-yl]acetamide

2-(5-methyl-1,2,4-oxadiazol-3-yl)-N-[1-(pyridine-3-carbonyl)-2,3-dihydroindol-5-yl]acetamide (PubChem CID 110623427) has the molecular formula C19H17N5O3 and a molecular weight of 363.38 g/mol. Its IUPAC name is 2-(5-methyl-1,2,4-oxadiazol-3-yl)-N-[1-(pyridine-3-carbonyl)-2,3-dihydroindol-5-yl]acetamide.

Molecular Properties

Compound Name2-(5-methyl-1,2,4-oxadiazol-3-yl)-N-[1-(pyridine-3-carbonyl)-2,3-dihydroindol-5-yl]acetamide
PubChem CID110623427
Molecular FormulaC19H17N5O3
Molecular Weight363.38 g/mol
Exact Mass363.13
IUPAC Name2-(5-methyl-1,2,4-oxadiazol-3-yl)-N-[1-(pyridine-3-carbonyl)-2,3-dihydroindol-5-yl]acetamide
SMILESCc1nc(CC(=O)Nc2ccc3c(c2)CCN3C(=O)c2cccnc2)no1
InChIInChI=1S/C19H17N5O3/c1-12-21-17(23-27-12)10-18(25)22-15-4-5-16-13(9-15)6-8-24(16)19(26)14-3-2-7-20-11-14/h2-5,7,9,11H,6,8,10H2,1H3,(H,22,25)
InChIKeyQJGVZXQRBVDVRC-UHFFFAOYSA-N
XLogP2.16
TPSA101.22 Ų
H-Bond Donors1
H-Bond Acceptors6
Rotatable Bonds4
Heavy Atoms27
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500363.38
LogP ≤ 52.16
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 106

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Frequently Asked Questions

What is the IUPAC name of 2-(5-methyl-1,2,4-oxadiazol-3-yl)-N-[1-(pyridine-3-carbonyl)-2,3-dihydroindol-5-yl]acetamide?
The IUPAC name of 2-(5-methyl-1,2,4-oxadiazol-3-yl)-N-[1-(pyridine-3-carbonyl)-2,3-dihydroindol-5-yl]acetamide (CID 110623427) is 2-(5-methyl-1,2,4-oxadiazol-3-yl)-N-[1-(pyridine-3-carbonyl)-2,3-dihydroindol-5-yl]acetamide.
What is the SMILES notation for 2-(5-methyl-1,2,4-oxadiazol-3-yl)-N-[1-(pyridine-3-carbonyl)-2,3-dihydroindol-5-yl]acetamide?
The canonical SMILES for 2-(5-methyl-1,2,4-oxadiazol-3-yl)-N-[1-(pyridine-3-carbonyl)-2,3-dihydroindol-5-yl]acetamide is Cc1nc(CC(=O)Nc2ccc3c(c2)CCN3C(=O)c2cccnc2)no1.
What is the InChIKey of 2-(5-methyl-1,2,4-oxadiazol-3-yl)-N-[1-(pyridine-3-carbonyl)-2,3-dihydroindol-5-yl]acetamide?
The InChIKey is QJGVZXQRBVDVRC-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H17N5O3/c1-12-21-17(23-27-12)10-18(25)22-15-4-5-16-13(9-15)6-8-24(16)19(26)14-3-2-7-20-11-14/h2-5,7,9,11H,6,8,10H2,1H3,(H,22,25).
What are the key properties of 2-(5-methyl-1,2,4-oxadiazol-3-yl)-N-[1-(pyridine-3-carbonyl)-2,3-dihydroindol-5-yl]acetamide?
2-(5-methyl-1,2,4-oxadiazol-3-yl)-N-[1-(pyridine-3-carbonyl)-2,3-dihydroindol-5-yl]acetamide has a molecular weight of 363.38 g/mol, XLogP of 2.16, 4 rotatable bonds, 1 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(5-methyl-1,2,4-oxadiazol-3-yl)-N-[1-(pyridine-3-carbonyl)-2,3-dihydroindol-5-yl]acetamide is sourced from PubChem (CID 110623427), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).