2-(2-methylindol-1-yl)-N-(6-oxopiperidin-3-yl)acetamide

C16H19N3O2 — CID 62491076

IUPAC2-(2-methylindol-1-yl)-N-(6-oxopiperidin-3-yl)acetamide
SMILESCc1cc2ccccc2n1CC(=O)NC1CCC(=O)NC1
InChIInChI=1S/C16H19N3O2/c1-11-8-12-4-2-3-5-14(12)19(11)10-16(21)18-13-6-7-15(20)17-9-13/h2-5,8,13H,6-7,9-10H2,1H3,(H,17,20)(H,18,21)
InChIKeyZJZCWAFQXSKDRX-UHFFFAOYSA-N
MW285.35 g/mol
LogP1.34
Rot. Bonds3

About 2-(2-methylindol-1-yl)-N-(6-oxopiperidin-3-yl)acetamide

2-(2-methylindol-1-yl)-N-(6-oxopiperidin-3-yl)acetamide (PubChem CID 62491076) has the molecular formula C16H19N3O2 and a molecular weight of 285.35 g/mol. Its IUPAC name is 2-(2-methylindol-1-yl)-N-(6-oxopiperidin-3-yl)acetamide.

Molecular Properties

Compound Name2-(2-methylindol-1-yl)-N-(6-oxopiperidin-3-yl)acetamide
PubChem CID62491076
Molecular FormulaC16H19N3O2
Molecular Weight285.35 g/mol
Exact Mass285.15
IUPAC Name2-(2-methylindol-1-yl)-N-(6-oxopiperidin-3-yl)acetamide
SMILESCc1cc2ccccc2n1CC(=O)NC1CCC(=O)NC1
InChIInChI=1S/C16H19N3O2/c1-11-8-12-4-2-3-5-14(12)19(11)10-16(21)18-13-6-7-15(20)17-9-13/h2-5,8,13H,6-7,9-10H2,1H3,(H,17,20)(H,18,21)
InChIKeyZJZCWAFQXSKDRX-UHFFFAOYSA-N
XLogP1.34
TPSA63.13 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500285.35
LogP ≤ 51.34
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 2-(2-methylindol-1-yl)-N-(6-oxopiperidin-3-yl)acetamide?
The IUPAC name of 2-(2-methylindol-1-yl)-N-(6-oxopiperidin-3-yl)acetamide (CID 62491076) is 2-(2-methylindol-1-yl)-N-(6-oxopiperidin-3-yl)acetamide.
What is the SMILES notation for 2-(2-methylindol-1-yl)-N-(6-oxopiperidin-3-yl)acetamide?
The canonical SMILES for 2-(2-methylindol-1-yl)-N-(6-oxopiperidin-3-yl)acetamide is Cc1cc2ccccc2n1CC(=O)NC1CCC(=O)NC1.
What is the InChIKey of 2-(2-methylindol-1-yl)-N-(6-oxopiperidin-3-yl)acetamide?
The InChIKey is ZJZCWAFQXSKDRX-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H19N3O2/c1-11-8-12-4-2-3-5-14(12)19(11)10-16(21)18-13-6-7-15(20)17-9-13/h2-5,8,13H,6-7,9-10H2,1H3,(H,17,20)(H,18,21).
What are the key properties of 2-(2-methylindol-1-yl)-N-(6-oxopiperidin-3-yl)acetamide?
2-(2-methylindol-1-yl)-N-(6-oxopiperidin-3-yl)acetamide has a molecular weight of 285.35 g/mol, XLogP of 1.34, 3 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(2-methylindol-1-yl)-N-(6-oxopiperidin-3-yl)acetamide is sourced from PubChem (CID 62491076), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).