N-(2,3-dihydro-1H-indol-5-yl)-2,2,3,3-tetrafluoropropanamide;hydrochloride

C11H11ClF4N2O — CID 119473799

IUPACN-(2,3-dihydro-1H-indol-5-yl)-2,2,3,3-tetrafluoropropanamide;hydrochloride
SMILESCl.O=C(Nc1ccc2c(c1)CCN2)C(F)(F)C(F)F
InChIInChI=1S/C11H10F4N2O.ClH/c12-9(13)11(14,15)10(18)17-7-1-2-8-6(5-7)3-4-16-8;/h1-2,5,9,16H,3-4H2,(H,17,18);1H
InChIKeyATEHNZFLKZWROH-UHFFFAOYSA-N
MW298.67 g/mol
LogP2.92
Rot. Bonds3

About N-(2,3-dihydro-1H-indol-5-yl)-2,2,3,3-tetrafluoropropanamide;hydrochloride

N-(2,3-dihydro-1H-indol-5-yl)-2,2,3,3-tetrafluoropropanamide;hydrochloride (PubChem CID 119473799) has the molecular formula C11H11ClF4N2O and a molecular weight of 298.67 g/mol. Its IUPAC name is N-(2,3-dihydro-1H-indol-5-yl)-2,2,3,3-tetrafluoropropanamide;hydrochloride.

Molecular Properties

Compound NameN-(2,3-dihydro-1H-indol-5-yl)-2,2,3,3-tetrafluoropropanamide;hydrochloride
PubChem CID119473799
Molecular FormulaC11H11ClF4N2O
Molecular Weight298.67 g/mol
Exact Mass298.05
IUPAC NameN-(2,3-dihydro-1H-indol-5-yl)-2,2,3,3-tetrafluoropropanamide;hydrochloride
SMILESCl.O=C(Nc1ccc2c(c1)CCN2)C(F)(F)C(F)F
InChIInChI=1S/C11H10F4N2O.ClH/c12-9(13)11(14,15)10(18)17-7-1-2-8-6(5-7)3-4-16-8;/h1-2,5,9,16H,3-4H2,(H,17,18);1H
InChIKeyATEHNZFLKZWROH-UHFFFAOYSA-N
XLogP2.92
TPSA41.13 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500298.67
LogP ≤ 52.92
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

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

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Related Compounds

N-(2,3-dihydro-1H-indol-5-yl)-2-methyl-2-methylsulfonylpropanamide;hydrochloride
CID 119473761
2,2,3,3-tetrafluoro-N-(4-fluorophenyl)propanamide
CID 103731851
N-(2,3-dihydro-1H-indol-5-yl)-2-methyl-2-phenylpropanamide
CID 63253292
N-(2,3-dihydro-1H-indol-5-yl)-3,4,4-trimethylpentanamide;hydrochloride
CID 119473758
N-(2,3-dihydro-1H-indol-5-yl)-2-methoxypropanamide
CID 115736922
N-(4-acetamidophenyl)-2,2,3,3-tetrafluoropropanamide
CID 103731824
N-(2,3-dihydro-1H-indol-5-yl)-2-methylsulfonylacetamide;hydrochloride
CID 119473829
N-(2,3-dihydro-1H-indol-5-yl)-3,4,5-trifluorobenzamide
CID 63252893
N-(2,3-dihydro-1H-indol-5-yl)-3,4,4-trimethylpentanamide
CID 63834008
N-(2,3-dihydro-1H-indol-5-yl)cyclobutanecarboxamide
CID 63252649
N-(2,3-dihydro-1H-indol-5-yl)butanamide
CID 63253204
N-(2,3-dihydro-1H-indol-5-yl)-1-methylcyclopropane-1-carboxamide
CID 119473770

Frequently Asked Questions

What is the IUPAC name of N-(2,3-dihydro-1H-indol-5-yl)-2,2,3,3-tetrafluoropropanamide;hydrochloride?
The IUPAC name of N-(2,3-dihydro-1H-indol-5-yl)-2,2,3,3-tetrafluoropropanamide;hydrochloride (CID 119473799) is N-(2,3-dihydro-1H-indol-5-yl)-2,2,3,3-tetrafluoropropanamide;hydrochloride.
What is the SMILES notation for N-(2,3-dihydro-1H-indol-5-yl)-2,2,3,3-tetrafluoropropanamide;hydrochloride?
The canonical SMILES for N-(2,3-dihydro-1H-indol-5-yl)-2,2,3,3-tetrafluoropropanamide;hydrochloride is Cl.O=C(Nc1ccc2c(c1)CCN2)C(F)(F)C(F)F.
What is the InChIKey of N-(2,3-dihydro-1H-indol-5-yl)-2,2,3,3-tetrafluoropropanamide;hydrochloride?
The InChIKey is ATEHNZFLKZWROH-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H10F4N2O.ClH/c12-9(13)11(14,15)10(18)17-7-1-2-8-6(5-7)3-4-16-8;/h1-2,5,9,16H,3-4H2,(H,17,18);1H.
What are the key properties of N-(2,3-dihydro-1H-indol-5-yl)-2,2,3,3-tetrafluoropropanamide;hydrochloride?
N-(2,3-dihydro-1H-indol-5-yl)-2,2,3,3-tetrafluoropropanamide;hydrochloride has a molecular weight of 298.67 g/mol, XLogP of 2.92, 3 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2,3-dihydro-1H-indol-5-yl)-2,2,3,3-tetrafluoropropanamide;hydrochloride is sourced from PubChem (CID 119473799), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).