5-(3-amino-1H-pyrazol-5-yl)-7-fluoro-1,3-dihydroindol-2-one

C11H9FN4O — CID 117335864

IUPAC5-(3-amino-1H-pyrazol-5-yl)-7-fluoro-1,3-dihydroindol-2-one
SMILESNc1cc(-c2cc(F)c3c(c2)CC(=O)N3)[nH]n1
InChIInChI=1S/C11H9FN4O/c12-7-2-5(8-4-9(13)16-15-8)1-6-3-10(17)14-11(6)7/h1-2,4H,3H2,(H,14,17)(H3,13,15,16)
InChIKeyNWRIVNWCTGATMH-UHFFFAOYSA-N
MW232.22 g/mol
LogP1.29
Rot. Bonds1

About 5-(3-amino-1H-pyrazol-5-yl)-7-fluoro-1,3-dihydroindol-2-one

5-(3-amino-1H-pyrazol-5-yl)-7-fluoro-1,3-dihydroindol-2-one (PubChem CID 117335864) has the molecular formula C11H9FN4O and a molecular weight of 232.22 g/mol. Its IUPAC name is 5-(3-amino-1H-pyrazol-5-yl)-7-fluoro-1,3-dihydroindol-2-one.

Molecular Properties

Compound Name5-(3-amino-1H-pyrazol-5-yl)-7-fluoro-1,3-dihydroindol-2-one
PubChem CID117335864
Molecular FormulaC11H9FN4O
Molecular Weight232.22 g/mol
Exact Mass232.08
IUPAC Name5-(3-amino-1H-pyrazol-5-yl)-7-fluoro-1,3-dihydroindol-2-one
SMILESNc1cc(-c2cc(F)c3c(c2)CC(=O)N3)[nH]n1
InChIInChI=1S/C11H9FN4O/c12-7-2-5(8-4-9(13)16-15-8)1-6-3-10(17)14-11(6)7/h1-2,4H,3H2,(H,14,17)(H3,13,15,16)
InChIKeyNWRIVNWCTGATMH-UHFFFAOYSA-N
XLogP1.29
TPSA83.80 Ų
H-Bond Donors3
H-Bond Acceptors3
Rotatable Bonds1
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500232.22
LogP ≤ 51.29
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 103

Analyze 5-(3-amino-1H-pyrazol-5-yl)-7-fluoro-1,3-dihydroindol-2-one with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

3-(7-fluoro-2-oxo-1,3-dihydroindol-5-yl)-1H-pyrazole-5-carboxylic acid
CID 117406570
5-(3,4,5-trifluorophenyl)-1H-pyrazol-3-amine
CID 63186082
7-fluoro-5-(5-fluoro-3-pyridinyl)-1,3-dihydroindol-2-one
CID 58255499
6-(2-amino-1,3-thiazol-4-yl)-8-fluoro-3,4-dihydro-1H-quinolin-2-one
CID 82104985
7-fluoro-5-propan-2-yloxy-1,3-dihydroindol-2-one
CID 71144685
7-fluoro-5-(3-nitropropyl)-1,3-dihydroindol-2-one
CID 69468406
5-(3-amino-1H-pyrazol-5-yl)-3-fluoro-2-hydroxybenzonitrile
CID 137013108
7-(5-amino-1,2-oxazol-3-yl)-5-fluoro-1,3-dihydroindol-2-one
CID 117337397
5-[amino(cyclohexyl)methyl]-7-fluoro-1,3-dihydroindol-2-one
CID 82173516
7-fluoro-5-(1-hydroxypropyl)-1,3-dihydroindol-2-one
CID 82173521
4-(3-amino-1H-pyrazol-5-yl)-1,3-dihydroindol-2-one
CID 117305337
7-chloro-5-(3,5-dichloro-4-pyridinyl)-1,3-dihydroindol-2-one
CID 122655698

Frequently Asked Questions

What is the IUPAC name of 5-(3-amino-1H-pyrazol-5-yl)-7-fluoro-1,3-dihydroindol-2-one?
The IUPAC name of 5-(3-amino-1H-pyrazol-5-yl)-7-fluoro-1,3-dihydroindol-2-one (CID 117335864) is 5-(3-amino-1H-pyrazol-5-yl)-7-fluoro-1,3-dihydroindol-2-one.
What is the SMILES notation for 5-(3-amino-1H-pyrazol-5-yl)-7-fluoro-1,3-dihydroindol-2-one?
The canonical SMILES for 5-(3-amino-1H-pyrazol-5-yl)-7-fluoro-1,3-dihydroindol-2-one is Nc1cc(-c2cc(F)c3c(c2)CC(=O)N3)[nH]n1.
What is the InChIKey of 5-(3-amino-1H-pyrazol-5-yl)-7-fluoro-1,3-dihydroindol-2-one?
The InChIKey is NWRIVNWCTGATMH-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H9FN4O/c12-7-2-5(8-4-9(13)16-15-8)1-6-3-10(17)14-11(6)7/h1-2,4H,3H2,(H,14,17)(H3,13,15,16).
What are the key properties of 5-(3-amino-1H-pyrazol-5-yl)-7-fluoro-1,3-dihydroindol-2-one?
5-(3-amino-1H-pyrazol-5-yl)-7-fluoro-1,3-dihydroindol-2-one has a molecular weight of 232.22 g/mol, XLogP of 1.29, 1 rotatable bonds, 3 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 5-(3-amino-1H-pyrazol-5-yl)-7-fluoro-1,3-dihydroindol-2-one is sourced from PubChem (CID 117335864), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).