5-chloro-3-(1H-pyrazol-4-ylamino)-1,3-dihydroindol-2-one

C11H9ClN4O — CID 43539934

IUPAC5-chloro-3-(1H-pyrazol-4-ylamino)-1,3-dihydroindol-2-one
SMILESO=C1Nc2ccc(Cl)cc2C1Nc1cn[nH]c1
InChIInChI=1S/C11H9ClN4O/c12-6-1-2-9-8(3-6)10(11(17)16-9)15-7-4-13-14-5-7/h1-5,10,15H,(H,13,14)(H,16,17)
InChIKeyNSPSIFJUEYRSRK-UHFFFAOYSA-N
MW248.67 g/mol
LogP2.17
Rot. Bonds2

About 5-chloro-3-(1H-pyrazol-4-ylamino)-1,3-dihydroindol-2-one

5-chloro-3-(1H-pyrazol-4-ylamino)-1,3-dihydroindol-2-one (PubChem CID 43539934) has the molecular formula C11H9ClN4O and a molecular weight of 248.67 g/mol. Its IUPAC name is 5-chloro-3-(1H-pyrazol-4-ylamino)-1,3-dihydroindol-2-one.

Molecular Properties

Compound Name5-chloro-3-(1H-pyrazol-4-ylamino)-1,3-dihydroindol-2-one
PubChem CID43539934
Molecular FormulaC11H9ClN4O
Molecular Weight248.67 g/mol
Exact Mass248.05
IUPAC Name5-chloro-3-(1H-pyrazol-4-ylamino)-1,3-dihydroindol-2-one
SMILESO=C1Nc2ccc(Cl)cc2C1Nc1cn[nH]c1
InChIInChI=1S/C11H9ClN4O/c12-6-1-2-9-8(3-6)10(11(17)16-9)15-7-4-13-14-5-7/h1-5,10,15H,(H,13,14)(H,16,17)
InChIKeyNSPSIFJUEYRSRK-UHFFFAOYSA-N
XLogP2.17
TPSA69.81 Ų
H-Bond Donors3
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500248.67
LogP ≤ 52.17
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 103

Analyze 5-chloro-3-(1H-pyrazol-4-ylamino)-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

5-chloro-3-(4-propan-2-ylanilino)-1,3-dihydroindol-2-one
CID 43098124
5-chloro-3-(3-methoxyanilino)-1,3-dihydroindol-2-one
CID 43196411
3-(1-benzothiophen-5-ylamino)-5-chloro-1,3-dihydroindol-2-one
CID 43687791
5-chloro-3-(3-iodo-4-methylanilino)-1,3-dihydroindol-2-one
CID 43716228
3-(4-bromo-2,6-dichloroanilino)-5-chloro-1,3-dihydroindol-2-one
CID 43126586
5-chloro-3-(5-chloro-2-methylanilino)-1,3-dihydroindol-2-one
CID 43097456
5-chloro-3-(2,3,4-trifluoroanilino)-1,3-dihydroindol-2-one
CID 43095076
3-(5-bromo-2-fluoroanilino)-5-chloro-1,3-dihydroindol-2-one
CID 43555314
3-(3,5-dichloroanilino)-5-methyl-1,3-dihydroindol-2-one
CID 43098558
3-(3-chloro-4-fluoroanilino)-5-fluoro-1,3-dihydroindol-2-one
CID 43119152
3-(4-bromo-2-chloroanilino)-5-chloro-1,3-dihydroindol-2-one
CID 43347233
5-chloro-3-(2,3-dihydro-1-benzofuran-5-ylamino)-1,3-dihydroindol-2-one
CID 43732708

Frequently Asked Questions

What is the IUPAC name of 5-chloro-3-(1H-pyrazol-4-ylamino)-1,3-dihydroindol-2-one?
The IUPAC name of 5-chloro-3-(1H-pyrazol-4-ylamino)-1,3-dihydroindol-2-one (CID 43539934) is 5-chloro-3-(1H-pyrazol-4-ylamino)-1,3-dihydroindol-2-one.
What is the SMILES notation for 5-chloro-3-(1H-pyrazol-4-ylamino)-1,3-dihydroindol-2-one?
The canonical SMILES for 5-chloro-3-(1H-pyrazol-4-ylamino)-1,3-dihydroindol-2-one is O=C1Nc2ccc(Cl)cc2C1Nc1cn[nH]c1.
What is the InChIKey of 5-chloro-3-(1H-pyrazol-4-ylamino)-1,3-dihydroindol-2-one?
The InChIKey is NSPSIFJUEYRSRK-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H9ClN4O/c12-6-1-2-9-8(3-6)10(11(17)16-9)15-7-4-13-14-5-7/h1-5,10,15H,(H,13,14)(H,16,17).
What are the key properties of 5-chloro-3-(1H-pyrazol-4-ylamino)-1,3-dihydroindol-2-one?
5-chloro-3-(1H-pyrazol-4-ylamino)-1,3-dihydroindol-2-one has a molecular weight of 248.67 g/mol, XLogP of 2.17, 2 rotatable bonds, 3 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 5-chloro-3-(1H-pyrazol-4-ylamino)-1,3-dihydroindol-2-one is sourced from PubChem (CID 43539934), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).