N-(2-fluorophenyl)-1-methyl-2-oxospiro[indole-3,3'-pyrrolidine]-1'-carboxamide

C19H18FN3O2 — CID 53177202

IUPACN-(2-fluorophenyl)-1-methyl-2-oxospiro[indole-3,3'-pyrrolidine]-1'-carboxamide
SMILESCN1C(=O)C2(CCN(C(=O)Nc3ccccc3F)C2)c2ccccc21
InChIInChI=1S/C19H18FN3O2/c1-22-16-9-5-2-6-13(16)19(17(22)24)10-11-23(12-19)18(25)21-15-8-4-3-7-14(15)20/h2-9H,10-12H2,1H3,(H,21,25)
InChIKeyNYRKIZYLYXZHJH-UHFFFAOYSA-N
MW339.37 g/mol
LogP2.98
Rot. Bonds1

About N-(2-fluorophenyl)-1-methyl-2-oxospiro[indole-3,3'-pyrrolidine]-1'-carboxamide

N-(2-fluorophenyl)-1-methyl-2-oxospiro[indole-3,3'-pyrrolidine]-1'-carboxamide (PubChem CID 53177202) has the molecular formula C19H18FN3O2 and a molecular weight of 339.37 g/mol. Its IUPAC name is N-(2-fluorophenyl)-1-methyl-2-oxospiro[indole-3,3'-pyrrolidine]-1'-carboxamide.

Molecular Properties

Compound NameN-(2-fluorophenyl)-1-methyl-2-oxospiro[indole-3,3'-pyrrolidine]-1'-carboxamide
PubChem CID53177202
Molecular FormulaC19H18FN3O2
Molecular Weight339.37 g/mol
Exact Mass339.14
IUPAC NameN-(2-fluorophenyl)-1-methyl-2-oxospiro[indole-3,3'-pyrrolidine]-1'-carboxamide
SMILESCN1C(=O)C2(CCN(C(=O)Nc3ccccc3F)C2)c2ccccc21
InChIInChI=1S/C19H18FN3O2/c1-22-16-9-5-2-6-13(16)19(17(22)24)10-11-23(12-19)18(25)21-15-8-4-3-7-14(15)20/h2-9H,10-12H2,1H3,(H,21,25)
InChIKeyNYRKIZYLYXZHJH-UHFFFAOYSA-N
XLogP2.98
TPSA52.65 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds1
Heavy Atoms25
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500339.37
LogP ≤ 52.98
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

3-ethyl-3-{4-[4-(4-fluorophenyl)-piperazin-1-yl]-butyl}-1,3-dihydro-2H-indol-2-one
CID 24854187
Spiro(indoline-3,4'-piperidin)-2-one, 1'-ethyl-
CID 3042076
tert-butyl (2'S,3S)-2-oxo-2'-(3-phenylphenyl)spiro[1H-indole-3,3'-pyrrolidine]-1'-carboxylate
CID 162671542
3-[2-(2,3-Dihydroindol-1-yl)-2-oxoethyl]-5-methyl-5-(4-methylphenyl)imidazolidine-2,4-dione
CID 3606093
Spiro[2H-indole-2,2'-piperidin]-6'-one, 1,3-dihydro-1,3,3-trimethyl-
CID 3242250
3-ethyl-3-[4-[4-(4-fluorophenyl)-3,6-dihydro-2H-pyridin-1-yl]butyl]-1H-indol-2-one
CID 11524003
3-{4-[4-(4-Fluorophenyl)-piperazin-1-yl]-butyl}-1,3-dihydro-2H-indol-2-one
CID 11646336
1'-[(1R)-3-(methylamino)-1-phenylpropyl]spiro[cyclohexane-1,3'-indol]-2'(1'H)-one
CID 16038376
1'-[(1R)-1-(3-fluorophenyl)-3-(methylamino)propyl]spiro[cyclohexane-1,3'-indol]-2'(1'H)-one
CID 16067546
(R)-7-fluoro-1-(1-(3-fluorophenyl)-3-(methylamino)propyl)-3,3-dimethylindolin-2-one
CID 16067547
(R)-3,3-dimethyl-1-(3-(methylamino)-1-phenylpropyl)indolin-2-one
CID 16067550
(R)-7-fluoro-3,3-dimethyl-1-(3-(methylamino)-1-phenylpropyl)indolin-2-one
CID 16067551

Frequently Asked Questions

What is the IUPAC name of N-(2-fluorophenyl)-1-methyl-2-oxospiro[indole-3,3'-pyrrolidine]-1'-carboxamide?
The IUPAC name of N-(2-fluorophenyl)-1-methyl-2-oxospiro[indole-3,3'-pyrrolidine]-1'-carboxamide (CID 53177202) is N-(2-fluorophenyl)-1-methyl-2-oxospiro[indole-3,3'-pyrrolidine]-1'-carboxamide.
What is the SMILES notation for N-(2-fluorophenyl)-1-methyl-2-oxospiro[indole-3,3'-pyrrolidine]-1'-carboxamide?
The canonical SMILES for N-(2-fluorophenyl)-1-methyl-2-oxospiro[indole-3,3'-pyrrolidine]-1'-carboxamide is CN1C(=O)C2(CCN(C(=O)Nc3ccccc3F)C2)c2ccccc21.
What is the InChIKey of N-(2-fluorophenyl)-1-methyl-2-oxospiro[indole-3,3'-pyrrolidine]-1'-carboxamide?
The InChIKey is NYRKIZYLYXZHJH-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H18FN3O2/c1-22-16-9-5-2-6-13(16)19(17(22)24)10-11-23(12-19)18(25)21-15-8-4-3-7-14(15)20/h2-9H,10-12H2,1H3,(H,21,25).
What are the key properties of N-(2-fluorophenyl)-1-methyl-2-oxospiro[indole-3,3'-pyrrolidine]-1'-carboxamide?
N-(2-fluorophenyl)-1-methyl-2-oxospiro[indole-3,3'-pyrrolidine]-1'-carboxamide has a molecular weight of 339.37 g/mol, XLogP of 2.98, 1 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2-fluorophenyl)-1-methyl-2-oxospiro[indole-3,3'-pyrrolidine]-1'-carboxamide is sourced from PubChem (CID 53177202), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).