2-(1,2-dimethylindol-3-yl)acetamide

C12H14N2O — CID 67627690

IUPAC2-(1,2-dimethylindol-3-yl)acetamide
SMILESCc1c(CC(N)=O)c2ccccc2n1C
InChIInChI=1S/C12H14N2O/c1-8-10(7-12(13)15)9-5-3-4-6-11(9)14(8)2/h3-6H,7H2,1-2H3,(H2,13,15)
InChIKeySFRBKVIXQGAMIA-UHFFFAOYSA-N
MW202.26 g/mol
LogP1.51
Rot. Bonds2

About 2-(1,2-dimethylindol-3-yl)acetamide

2-(1,2-dimethylindol-3-yl)acetamide (PubChem CID 67627690) has the molecular formula C12H14N2O and a molecular weight of 202.26 g/mol. Its IUPAC name is 2-(1,2-dimethylindol-3-yl)acetamide.

Molecular Properties

Compound Name2-(1,2-dimethylindol-3-yl)acetamide
PubChem CID67627690
Molecular FormulaC12H14N2O
Molecular Weight202.26 g/mol
Exact Mass202.11
IUPAC Name2-(1,2-dimethylindol-3-yl)acetamide
SMILESCc1c(CC(N)=O)c2ccccc2n1C
InChIInChI=1S/C12H14N2O/c1-8-10(7-12(13)15)9-5-3-4-6-11(9)14(8)2/h3-6H,7H2,1-2H3,(H2,13,15)
InChIKeySFRBKVIXQGAMIA-UHFFFAOYSA-N
XLogP1.51
TPSA48.02 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500202.26
LogP ≤ 51.51
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'indol_3yl_alk(461)', 'substructure': 'N/A'}

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Frequently Asked Questions

What is the IUPAC name of 2-(1,2-dimethylindol-3-yl)acetamide?
The IUPAC name of 2-(1,2-dimethylindol-3-yl)acetamide (CID 67627690) is 2-(1,2-dimethylindol-3-yl)acetamide.
What is the SMILES notation for 2-(1,2-dimethylindol-3-yl)acetamide?
The canonical SMILES for 2-(1,2-dimethylindol-3-yl)acetamide is Cc1c(CC(N)=O)c2ccccc2n1C.
What is the InChIKey of 2-(1,2-dimethylindol-3-yl)acetamide?
The InChIKey is SFRBKVIXQGAMIA-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H14N2O/c1-8-10(7-12(13)15)9-5-3-4-6-11(9)14(8)2/h3-6H,7H2,1-2H3,(H2,13,15).
What are the key properties of 2-(1,2-dimethylindol-3-yl)acetamide?
2-(1,2-dimethylindol-3-yl)acetamide has a molecular weight of 202.26 g/mol, XLogP of 1.51, 2 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(1,2-dimethylindol-3-yl)acetamide is sourced from PubChem (CID 67627690), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).