1-methyl-N-(5-methyl-1H-indol-6-yl)-6-oxopiperidine-2-carboxamide

C16H19N3O2 — CID 146133051

IUPAC1-methyl-N-(5-methyl-1H-indol-6-yl)-6-oxopiperidine-2-carboxamide
SMILESCc1cc2cc[nH]c2cc1NC(=O)C1CCCC(=O)N1C
InChIInChI=1S/C16H19N3O2/c1-10-8-11-6-7-17-13(11)9-12(10)18-16(21)14-4-3-5-15(20)19(14)2/h6-9,14,17H,3-5H2,1-2H3,(H,18,21)
InChIKeyQNEOKJQBWPWCGG-UHFFFAOYSA-N
MW285.35 g/mol
LogP2.43
Rot. Bonds2

About 1-methyl-N-(5-methyl-1H-indol-6-yl)-6-oxopiperidine-2-carboxamide

1-methyl-N-(5-methyl-1H-indol-6-yl)-6-oxopiperidine-2-carboxamide (PubChem CID 146133051) has the molecular formula C16H19N3O2 and a molecular weight of 285.35 g/mol. Its IUPAC name is 1-methyl-N-(5-methyl-1H-indol-6-yl)-6-oxopiperidine-2-carboxamide.

Molecular Properties

Compound Name1-methyl-N-(5-methyl-1H-indol-6-yl)-6-oxopiperidine-2-carboxamide
PubChem CID146133051
Molecular FormulaC16H19N3O2
Molecular Weight285.35 g/mol
Exact Mass285.15
IUPAC Name1-methyl-N-(5-methyl-1H-indol-6-yl)-6-oxopiperidine-2-carboxamide
SMILESCc1cc2cc[nH]c2cc1NC(=O)C1CCCC(=O)N1C
InChIInChI=1S/C16H19N3O2/c1-10-8-11-6-7-17-13(11)9-12(10)18-16(21)14-4-3-5-15(20)19(14)2/h6-9,14,17H,3-5H2,1-2H3,(H,18,21)
InChIKeyQNEOKJQBWPWCGG-UHFFFAOYSA-N
XLogP2.43
TPSA65.20 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500285.35
LogP ≤ 52.43
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Related Compounds

N-(2,5-dimethylphenyl)-1-methyl-5-oxopyrrolidine-2-carboxamide
CID 110687327
N-(4-chloro-2-methylphenyl)-1-methyl-5-oxopyrrolidine-2-carboxamide
CID 110687350
N-[2-methoxy-4-(trifluoromethyl)phenyl]-1-methyl-6-oxopiperidine-2-carboxamide
CID 146133070
N-[1-(3-chlorophenyl)-5-methylpyrazol-4-yl]-1-methyl-6-oxopiperidine-2-carboxamide
CID 146133040
(2R)-N-[5-chloro-2-(methylcarbamoyl)phenyl]-1-methyl-5-oxopyrrolidine-2-carboxamide
CID 166256094
N-(4-acetamidophenyl)-1-methyl-5-oxopyrrolidine-2-carboxamide
CID 110687377
N-(2-methoxyphenyl)-1-methyl-5-oxopyrrolidine-2-carboxamide
CID 110687358
N-[2-(3-hydroxyphenyl)pyrimidin-5-yl]-1-methyl-6-oxopiperidine-2-carboxamide
CID 154786469
N-[5-(1H-indol-6-ylmethylcarbamoyl)-2-methylphenyl]-1-methylpiperidine-3-carboxamide
CID 172665416
N-[5-(2-methoxyphenyl)-4-methyl-1H-pyrazol-3-yl]-1-methyl-6-oxopiperidine-2-carboxamide
CID 146140217
N-(5-ethyl-1,3-thiazol-2-yl)-1-methyl-6-oxopiperidine-2-carboxamide
CID 166254325
1-methyl-6-oxo-N-[3-(2,2,2-trifluoroethoxy)phenyl]piperidine-2-carboxamide
CID 146138327

Frequently Asked Questions

What is the IUPAC name of 1-methyl-N-(5-methyl-1H-indol-6-yl)-6-oxopiperidine-2-carboxamide?
The IUPAC name of 1-methyl-N-(5-methyl-1H-indol-6-yl)-6-oxopiperidine-2-carboxamide (CID 146133051) is 1-methyl-N-(5-methyl-1H-indol-6-yl)-6-oxopiperidine-2-carboxamide.
What is the SMILES notation for 1-methyl-N-(5-methyl-1H-indol-6-yl)-6-oxopiperidine-2-carboxamide?
The canonical SMILES for 1-methyl-N-(5-methyl-1H-indol-6-yl)-6-oxopiperidine-2-carboxamide is Cc1cc2cc[nH]c2cc1NC(=O)C1CCCC(=O)N1C.
What is the InChIKey of 1-methyl-N-(5-methyl-1H-indol-6-yl)-6-oxopiperidine-2-carboxamide?
The InChIKey is QNEOKJQBWPWCGG-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H19N3O2/c1-10-8-11-6-7-17-13(11)9-12(10)18-16(21)14-4-3-5-15(20)19(14)2/h6-9,14,17H,3-5H2,1-2H3,(H,18,21).
What are the key properties of 1-methyl-N-(5-methyl-1H-indol-6-yl)-6-oxopiperidine-2-carboxamide?
1-methyl-N-(5-methyl-1H-indol-6-yl)-6-oxopiperidine-2-carboxamide has a molecular weight of 285.35 g/mol, XLogP of 2.43, 2 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 1-methyl-N-(5-methyl-1H-indol-6-yl)-6-oxopiperidine-2-carboxamide is sourced from PubChem (CID 146133051), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).