N,N-dimethyl-2-(2-methyl-1H-indol-3-yl)-2-oxoacetamide

C13H14N2O2 — CID 14134

IUPACN,N-dimethyl-2-(2-methyl-1H-indol-3-yl)-2-oxoacetamide
SMILESCc1[nH]c2ccccc2c1C(=O)C(=O)N(C)C
InChIInChI=1S/C13H14N2O2/c1-8-11(12(16)13(17)15(2)3)9-6-4-5-7-10(9)14-8/h4-7,14H,1-3H3
InChIKeyCBMCIRIKRUXCDP-UHFFFAOYSA-N
MW230.27 g/mol
LogP1.75
Rot. Bonds2

About N,N-dimethyl-2-(2-methyl-1H-indol-3-yl)-2-oxoacetamide

N,N-dimethyl-2-(2-methyl-1H-indol-3-yl)-2-oxoacetamide (PubChem CID 14134) has the molecular formula C13H14N2O2 and a molecular weight of 230.27 g/mol. Its IUPAC name is N,N-dimethyl-2-(2-methyl-1H-indol-3-yl)-2-oxoacetamide.

Molecular Properties

Compound NameN,N-dimethyl-2-(2-methyl-1H-indol-3-yl)-2-oxoacetamide
PubChem CID14134
Molecular FormulaC13H14N2O2
Molecular Weight230.27 g/mol
Exact Mass230.11
IUPAC NameN,N-dimethyl-2-(2-methyl-1H-indol-3-yl)-2-oxoacetamide
SMILESCc1[nH]c2ccccc2c1C(=O)C(=O)N(C)C
InChIInChI=1S/C13H14N2O2/c1-8-11(12(16)13(17)15(2)3)9-6-4-5-7-10(9)14-8/h4-7,14H,1-3H3
InChIKeyCBMCIRIKRUXCDP-UHFFFAOYSA-N
XLogP1.75
TPSA53.17 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500230.27
LogP ≤ 51.75
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'diketo_group', 'substructure': 'N/A'}

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Frequently Asked Questions

What is the IUPAC name of N,N-dimethyl-2-(2-methyl-1H-indol-3-yl)-2-oxoacetamide?
The IUPAC name of N,N-dimethyl-2-(2-methyl-1H-indol-3-yl)-2-oxoacetamide (CID 14134) is N,N-dimethyl-2-(2-methyl-1H-indol-3-yl)-2-oxoacetamide.
What is the SMILES notation for N,N-dimethyl-2-(2-methyl-1H-indol-3-yl)-2-oxoacetamide?
The canonical SMILES for N,N-dimethyl-2-(2-methyl-1H-indol-3-yl)-2-oxoacetamide is Cc1[nH]c2ccccc2c1C(=O)C(=O)N(C)C.
What is the InChIKey of N,N-dimethyl-2-(2-methyl-1H-indol-3-yl)-2-oxoacetamide?
The InChIKey is CBMCIRIKRUXCDP-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H14N2O2/c1-8-11(12(16)13(17)15(2)3)9-6-4-5-7-10(9)14-8/h4-7,14H,1-3H3.
What are the key properties of N,N-dimethyl-2-(2-methyl-1H-indol-3-yl)-2-oxoacetamide?
N,N-dimethyl-2-(2-methyl-1H-indol-3-yl)-2-oxoacetamide has a molecular weight of 230.27 g/mol, XLogP of 1.75, 2 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N,N-dimethyl-2-(2-methyl-1H-indol-3-yl)-2-oxoacetamide is sourced from PubChem (CID 14134), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).