2-(2,3-dihydro-1H-indol-7-yl)-N-methylacetamide

C11H14N2O — CID 115105290

IUPAC2-(2,3-dihydro-1H-indol-7-yl)-N-methylacetamide
SMILESCNC(=O)Cc1cccc2c1NCC2
InChIInChI=1S/C11H14N2O/c1-12-10(14)7-9-4-2-3-8-5-6-13-11(8)9/h2-4,13H,5-7H2,1H3,(H,12,14)
InChIKeyUPJOFKICJWMTDC-UHFFFAOYSA-N
MW190.25 g/mol
LogP0.94
Rot. Bonds2

About 2-(2,3-dihydro-1H-indol-7-yl)-N-methylacetamide

2-(2,3-dihydro-1H-indol-7-yl)-N-methylacetamide (PubChem CID 115105290) has the molecular formula C11H14N2O and a molecular weight of 190.25 g/mol. Its IUPAC name is 2-(2,3-dihydro-1H-indol-7-yl)-N-methylacetamide.

Molecular Properties

Compound Name2-(2,3-dihydro-1H-indol-7-yl)-N-methylacetamide
PubChem CID115105290
Molecular FormulaC11H14N2O
Molecular Weight190.25 g/mol
Exact Mass190.11
IUPAC Name2-(2,3-dihydro-1H-indol-7-yl)-N-methylacetamide
SMILESCNC(=O)Cc1cccc2c1NCC2
InChIInChI=1S/C11H14N2O/c1-12-10(14)7-9-4-2-3-8-5-6-13-11(8)9/h2-4,13H,5-7H2,1H3,(H,12,14)
InChIKeyUPJOFKICJWMTDC-UHFFFAOYSA-N
XLogP0.94
TPSA41.13 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms14
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500190.25
LogP ≤ 50.94
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 2-(2,3-dihydro-1H-indol-7-yl)-N-methylacetamide?
The IUPAC name of 2-(2,3-dihydro-1H-indol-7-yl)-N-methylacetamide (CID 115105290) is 2-(2,3-dihydro-1H-indol-7-yl)-N-methylacetamide.
What is the SMILES notation for 2-(2,3-dihydro-1H-indol-7-yl)-N-methylacetamide?
The canonical SMILES for 2-(2,3-dihydro-1H-indol-7-yl)-N-methylacetamide is CNC(=O)Cc1cccc2c1NCC2.
What is the InChIKey of 2-(2,3-dihydro-1H-indol-7-yl)-N-methylacetamide?
The InChIKey is UPJOFKICJWMTDC-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H14N2O/c1-12-10(14)7-9-4-2-3-8-5-6-13-11(8)9/h2-4,13H,5-7H2,1H3,(H,12,14).
What are the key properties of 2-(2,3-dihydro-1H-indol-7-yl)-N-methylacetamide?
2-(2,3-dihydro-1H-indol-7-yl)-N-methylacetamide has a molecular weight of 190.25 g/mol, XLogP of 0.94, 2 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(2,3-dihydro-1H-indol-7-yl)-N-methylacetamide is sourced from PubChem (CID 115105290), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).