2-[7-fluoro-3-oxo-5-(2-oxopyrrolidin-1-yl)-1,2-dihydroinden-2-yl]acetamide

C15H15FN2O3 — CID 123383493

IUPAC2-[7-fluoro-3-oxo-5-(2-oxopyrrolidin-1-yl)-1,2-dihydroinden-2-yl]acetamide
SMILESNC(=O)CC1Cc2c(F)cc(N3CCCC3=O)cc2C1=O
InChIInChI=1S/C15H15FN2O3/c16-12-7-9(18-3-1-2-14(18)20)6-11-10(12)4-8(15(11)21)5-13(17)19/h6-8H,1-5H2,(H2,17,19)
InChIKeyVQWIKDWNMMCIGH-UHFFFAOYSA-N
MW290.29 g/mol
LogP1.18
Rot. Bonds3

About 2-[7-fluoro-3-oxo-5-(2-oxopyrrolidin-1-yl)-1,2-dihydroinden-2-yl]acetamide

2-[7-fluoro-3-oxo-5-(2-oxopyrrolidin-1-yl)-1,2-dihydroinden-2-yl]acetamide (PubChem CID 123383493) has the molecular formula C15H15FN2O3 and a molecular weight of 290.29 g/mol. Its IUPAC name is 2-[7-fluoro-3-oxo-5-(2-oxopyrrolidin-1-yl)-1,2-dihydroinden-2-yl]acetamide.

Molecular Properties

Compound Name2-[7-fluoro-3-oxo-5-(2-oxopyrrolidin-1-yl)-1,2-dihydroinden-2-yl]acetamide
PubChem CID123383493
Molecular FormulaC15H15FN2O3
Molecular Weight290.29 g/mol
Exact Mass290.11
IUPAC Name2-[7-fluoro-3-oxo-5-(2-oxopyrrolidin-1-yl)-1,2-dihydroinden-2-yl]acetamide
SMILESNC(=O)CC1Cc2c(F)cc(N3CCCC3=O)cc2C1=O
InChIInChI=1S/C15H15FN2O3/c16-12-7-9(18-3-1-2-14(18)20)6-11-10(12)4-8(15(11)21)5-13(17)19/h6-8H,1-5H2,(H2,17,19)
InChIKeyVQWIKDWNMMCIGH-UHFFFAOYSA-N
XLogP1.18
TPSA80.47 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500290.29
LogP ≤ 51.18
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

2-[7-fluoro-3-oxo-5-(2-oxopyrrolidin-1-yl)-1H-isoindol-2-yl]acetic acid
CID 123659178
1-(3,5-dimethylphenyl)pyrrolidin-2-one
CID 847897
2-fluoro-4-(2-oxopyrrolidin-1-yl)benzonitrile
CID 53417042
1-[3-fluoro-5-(2-oxopyrrolidin-1-yl)-2-pyridinyl]-N,N-dimethylazetidine-3-carboxamide
CID 142414572
1-(3-amino-4-nitro-5-pyrimidin-2-ylphenyl)pyrrolidin-2-one
CID 89362409
5-oxo-1-[4-(2-oxopyrrolidin-1-yl)phenyl]pyrrolidine-3-carboxamide
CID 168697848
N-(2-aminoethyl)-3-(2-oxopyrrolidin-1-yl)-5-(trifluoromethyl)benzamide;hydrochloride
CID 119383232
1-[2-fluoro-4-(2-oxopiperidin-1-yl)phenyl]-2-oxopiperidine-3-carboxamide
CID 21071195
N-(3-amino-2,2-dimethylpropyl)-N-methyl-3-(2-oxopyrrolidin-1-yl)-5-(trifluoromethyl)benzamide
CID 119654050
6-[2-(2,3-dihydropyrazin-5-yl)ethyl]pyridin-3-ol;1-(7-fluoro-3-oxo-1,2-dihydroinden-5-yl)pyrrolidin-2-one
CID 144603433
1-(5-amino-2-fluorophenyl)pyrrolidin-2-one
CID 16771885
[4-(2-oxopyrrolidin-1-yl)phenyl] 2-(3,4-difluorophenyl)sulfanylacetate
CID 35545428

Frequently Asked Questions

What is the IUPAC name of 2-[7-fluoro-3-oxo-5-(2-oxopyrrolidin-1-yl)-1,2-dihydroinden-2-yl]acetamide?
The IUPAC name of 2-[7-fluoro-3-oxo-5-(2-oxopyrrolidin-1-yl)-1,2-dihydroinden-2-yl]acetamide (CID 123383493) is 2-[7-fluoro-3-oxo-5-(2-oxopyrrolidin-1-yl)-1,2-dihydroinden-2-yl]acetamide.
What is the SMILES notation for 2-[7-fluoro-3-oxo-5-(2-oxopyrrolidin-1-yl)-1,2-dihydroinden-2-yl]acetamide?
The canonical SMILES for 2-[7-fluoro-3-oxo-5-(2-oxopyrrolidin-1-yl)-1,2-dihydroinden-2-yl]acetamide is NC(=O)CC1Cc2c(F)cc(N3CCCC3=O)cc2C1=O.
What is the InChIKey of 2-[7-fluoro-3-oxo-5-(2-oxopyrrolidin-1-yl)-1,2-dihydroinden-2-yl]acetamide?
The InChIKey is VQWIKDWNMMCIGH-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H15FN2O3/c16-12-7-9(18-3-1-2-14(18)20)6-11-10(12)4-8(15(11)21)5-13(17)19/h6-8H,1-5H2,(H2,17,19).
What are the key properties of 2-[7-fluoro-3-oxo-5-(2-oxopyrrolidin-1-yl)-1,2-dihydroinden-2-yl]acetamide?
2-[7-fluoro-3-oxo-5-(2-oxopyrrolidin-1-yl)-1,2-dihydroinden-2-yl]acetamide has a molecular weight of 290.29 g/mol, XLogP of 1.18, 3 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[7-fluoro-3-oxo-5-(2-oxopyrrolidin-1-yl)-1,2-dihydroinden-2-yl]acetamide is sourced from PubChem (CID 123383493), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).