2,2,2-trifluoro-N-(1-methyl-2,3-dihydroindol-6-yl)acetamide

C11H11F3N2O — CID 153408429

IUPAC2,2,2-trifluoro-N-(1-methyl-2,3-dihydroindol-6-yl)acetamide
SMILESCN1CCc2ccc(NC(=O)C(F)(F)F)cc21
InChIInChI=1S/C11H11F3N2O/c1-16-5-4-7-2-3-8(6-9(7)16)15-10(17)11(12,13)14/h2-3,6H,4-5H2,1H3,(H,15,17)
InChIKeyZIGFASWICDJMBQ-UHFFFAOYSA-N
MW244.22 g/mol
LogP2.18
Rot. Bonds1

About 2,2,2-trifluoro-N-(1-methyl-2,3-dihydroindol-6-yl)acetamide

2,2,2-trifluoro-N-(1-methyl-2,3-dihydroindol-6-yl)acetamide (PubChem CID 153408429) has the molecular formula C11H11F3N2O and a molecular weight of 244.22 g/mol. Its IUPAC name is 2,2,2-trifluoro-N-(1-methyl-2,3-dihydroindol-6-yl)acetamide.

Molecular Properties

Compound Name2,2,2-trifluoro-N-(1-methyl-2,3-dihydroindol-6-yl)acetamide
PubChem CID153408429
Molecular FormulaC11H11F3N2O
Molecular Weight244.22 g/mol
Exact Mass244.08
IUPAC Name2,2,2-trifluoro-N-(1-methyl-2,3-dihydroindol-6-yl)acetamide
SMILESCN1CCc2ccc(NC(=O)C(F)(F)F)cc21
InChIInChI=1S/C11H11F3N2O/c1-16-5-4-7-2-3-8(6-9(7)16)15-10(17)11(12,13)14/h2-3,6H,4-5H2,1H3,(H,15,17)
InChIKeyZIGFASWICDJMBQ-UHFFFAOYSA-N
XLogP2.18
TPSA32.34 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds1
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500244.22
LogP ≤ 52.18
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

N-[5,6-dihydroxy-3-[(2,2,2-trifluoroacetyl)amino]-11,12-dihydrobenzo[c][1,2]benzodiazocin-8-yl]-2,2,2-trifluoroacetamide
CID 162580149
3,3-dimethyl-N-(1-methyl-2,3-dihydroindol-6-yl)butanamide
CID 110729245
N-(1-cyclohexyl-2,3-dihydroindol-6-yl)-2,2,2-trifluoroacetamide
CID 142743429
N-(2-acetyl-3,4-dihydro-1H-isoquinolin-7-yl)-2,2,2-trifluoroacetamide
CID 10565105
N-[3-chloro-4-(4-methylpiperazin-1-yl)phenyl]-2,2,2-trifluoroacetamide
CID 17334956
2-[(1-methyl-2,3-dihydroindol-6-yl)carbamoylamino]propanamide
CID 175745823
N-(1-methyl-3,4-dihydro-2H-quinolin-7-yl)cyclobutanecarboxamide
CID 110729129
3,4,5-trimethoxy-N-(1-methyl-2,3-dihydroindol-6-yl)benzamide
CID 110729223
N-(1-methyl-2,3-dihydroindol-6-yl)-3-[(4-methylpiperazin-1-yl)methyl]-5-(trifluoromethyl)benzamide
CID 165142702
3-amino-1-methyl-N-(1-methyl-2,3-dihydroindol-6-yl)pyrazole-4-carboxamide
CID 166261429
1-cyclopentyl-3-(1-methyl-3,4-dihydro-2H-quinolin-7-yl)urea
CID 110748659
2-(4-bromo-2-hydroxyphenyl)-N-(1-methyl-2,3-dihydroindol-6-yl)acetamide
CID 167811613

Frequently Asked Questions

What is the IUPAC name of 2,2,2-trifluoro-N-(1-methyl-2,3-dihydroindol-6-yl)acetamide?
The IUPAC name of 2,2,2-trifluoro-N-(1-methyl-2,3-dihydroindol-6-yl)acetamide (CID 153408429) is 2,2,2-trifluoro-N-(1-methyl-2,3-dihydroindol-6-yl)acetamide.
What is the SMILES notation for 2,2,2-trifluoro-N-(1-methyl-2,3-dihydroindol-6-yl)acetamide?
The canonical SMILES for 2,2,2-trifluoro-N-(1-methyl-2,3-dihydroindol-6-yl)acetamide is CN1CCc2ccc(NC(=O)C(F)(F)F)cc21.
What is the InChIKey of 2,2,2-trifluoro-N-(1-methyl-2,3-dihydroindol-6-yl)acetamide?
The InChIKey is ZIGFASWICDJMBQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H11F3N2O/c1-16-5-4-7-2-3-8(6-9(7)16)15-10(17)11(12,13)14/h2-3,6H,4-5H2,1H3,(H,15,17).
What are the key properties of 2,2,2-trifluoro-N-(1-methyl-2,3-dihydroindol-6-yl)acetamide?
2,2,2-trifluoro-N-(1-methyl-2,3-dihydroindol-6-yl)acetamide has a molecular weight of 244.22 g/mol, XLogP of 2.18, 1 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2,2,2-trifluoro-N-(1-methyl-2,3-dihydroindol-6-yl)acetamide is sourced from PubChem (CID 153408429), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).