2-(5-chloro-3,3-difluoro-2-oxoindol-1-yl)acetamide

C10H7ClF2N2O2 — CID 11543477

IUPAC2-(5-chloro-3,3-difluoro-2-oxoindol-1-yl)acetamide
SMILESNC(=O)CN1C(=O)C(F)(F)c2cc(Cl)ccc21
InChIInChI=1S/C10H7ClF2N2O2/c11-5-1-2-7-6(3-5)10(12,13)9(17)15(7)4-8(14)16/h1-3H,4H2,(H2,14,16)
InChIKeyZTINVWDIBKUCBK-UHFFFAOYSA-N
MW260.63 g/mol
LogP1.26
Rot. Bonds2

About 2-(5-chloro-3,3-difluoro-2-oxoindol-1-yl)acetamide

2-(5-chloro-3,3-difluoro-2-oxoindol-1-yl)acetamide (PubChem CID 11543477) has the molecular formula C10H7ClF2N2O2 and a molecular weight of 260.63 g/mol. Its IUPAC name is 2-(5-chloro-3,3-difluoro-2-oxoindol-1-yl)acetamide.

Molecular Properties

Compound Name2-(5-chloro-3,3-difluoro-2-oxoindol-1-yl)acetamide
PubChem CID11543477
Molecular FormulaC10H7ClF2N2O2
Molecular Weight260.63 g/mol
Exact Mass260.02
IUPAC Name2-(5-chloro-3,3-difluoro-2-oxoindol-1-yl)acetamide
SMILESNC(=O)CN1C(=O)C(F)(F)c2cc(Cl)ccc21
InChIInChI=1S/C10H7ClF2N2O2/c11-5-1-2-7-6(3-5)10(12,13)9(17)15(7)4-8(14)16/h1-3H,4H2,(H2,14,16)
InChIKeyZTINVWDIBKUCBK-UHFFFAOYSA-N
XLogP1.26
TPSA63.40 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500260.63
LogP ≤ 51.26
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

5-Chlorooxindole
CID 152801
1-(4-(4-(4-Chlorophenyl)-1-piperazinyl)butyl)indolin-2-one
CID 23653176
3-(3-chlorophenyl)-4-(2,3-dihydro-1H-indol-1-yl)-2,5-dihydro-1H-pyrrole-2,5-dione
CID 6539519
N-[4-chloro-2-(trifluoromethyl)phenyl]-2-pyrrolidin-1-ylacetamide
CID 4969408
N-(4-chlorophenyl)-2-[[2-(2,3-dihydroindol-1-yl)-2-oxoethyl]-methylamino]acetamide
CID 4824820
(2R)-1-[2-(4-chloro-3-fluorophenyl)acetyl]-N-methyl-2,3-dihydroindole-2-carboxamide
CID 122192203
5-chloro-1-methyl-2,3-dihydro-1H-indol-2-one
CID 10976112
N-[4-chloro-2-(trifluoromethyl)phenyl]-2-[[3-(dimethylamino)-2,2-dimethylpropyl]amino]-2-phenylacetamide
CID 4833217
N-(4-chlorophenyl)-2-(3,3-dimethyl-2-oxo-2,3-dihydro-1H-indol-1-yl)acetamide
CID 16031607
N-(4-chloro-2-methylphenyl)-2-(2,3-dioxo-2,3-dihydro-1H-indol-1-yl)acetamide
CID 1631467
6-chloro-3-piperazin-1-yl-3-(trifluoromethyl)-1,3-dihydro-2H-indol-2-one
CID 3236265
N-[4-chloro-2-(trifluoromethyl)phenyl]-2-[4-[2-(cyclopropylamino)-2-oxoethyl]piperazin-1-yl]-2-phenylacetamide
CID 16294933

Frequently Asked Questions

What is the IUPAC name of 2-(5-chloro-3,3-difluoro-2-oxoindol-1-yl)acetamide?
The IUPAC name of 2-(5-chloro-3,3-difluoro-2-oxoindol-1-yl)acetamide (CID 11543477) is 2-(5-chloro-3,3-difluoro-2-oxoindol-1-yl)acetamide.
What is the SMILES notation for 2-(5-chloro-3,3-difluoro-2-oxoindol-1-yl)acetamide?
The canonical SMILES for 2-(5-chloro-3,3-difluoro-2-oxoindol-1-yl)acetamide is NC(=O)CN1C(=O)C(F)(F)c2cc(Cl)ccc21.
What is the InChIKey of 2-(5-chloro-3,3-difluoro-2-oxoindol-1-yl)acetamide?
The InChIKey is ZTINVWDIBKUCBK-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H7ClF2N2O2/c11-5-1-2-7-6(3-5)10(12,13)9(17)15(7)4-8(14)16/h1-3H,4H2,(H2,14,16).
What are the key properties of 2-(5-chloro-3,3-difluoro-2-oxoindol-1-yl)acetamide?
2-(5-chloro-3,3-difluoro-2-oxoindol-1-yl)acetamide has a molecular weight of 260.63 g/mol, XLogP of 1.26, 2 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(5-chloro-3,3-difluoro-2-oxoindol-1-yl)acetamide is sourced from PubChem (CID 11543477), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).