6-chloro-5-(propylamino)-1,3-dihydroindol-2-one

C11H13ClN2O — CID 43691797

IUPAC6-chloro-5-(propylamino)-1,3-dihydroindol-2-one
SMILESCCCNc1cc2c(cc1Cl)NC(=O)C2
InChIInChI=1S/C11H13ClN2O/c1-2-3-13-10-4-7-5-11(15)14-9(7)6-8(10)12/h4,6,13H,2-3,5H2,1H3,(H,14,15)
InChIKeyZQRACBRDKTZVJX-UHFFFAOYSA-N
MW224.69 g/mol
LogP2.66
Rot. Bonds3

About 6-chloro-5-(propylamino)-1,3-dihydroindol-2-one

6-chloro-5-(propylamino)-1,3-dihydroindol-2-one (PubChem CID 43691797) has the molecular formula C11H13ClN2O and a molecular weight of 224.69 g/mol. Its IUPAC name is 6-chloro-5-(propylamino)-1,3-dihydroindol-2-one.

Molecular Properties

Compound Name6-chloro-5-(propylamino)-1,3-dihydroindol-2-one
PubChem CID43691797
Molecular FormulaC11H13ClN2O
Molecular Weight224.69 g/mol
Exact Mass224.07
IUPAC Name6-chloro-5-(propylamino)-1,3-dihydroindol-2-one
SMILESCCCNc1cc2c(cc1Cl)NC(=O)C2
InChIInChI=1S/C11H13ClN2O/c1-2-3-13-10-4-7-5-11(15)14-9(7)6-8(10)12/h4,6,13H,2-3,5H2,1H3,(H,14,15)
InChIKeyZQRACBRDKTZVJX-UHFFFAOYSA-N
XLogP2.66
TPSA41.13 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500224.69
LogP ≤ 52.66
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Related Compounds

tert-butyl N-[3-[(6-chloro-2-oxo-1,3-dihydroindol-5-yl)amino]propyl]carbamate
CID 103821736
6-chloro-5-[(4-chlorophenyl)methylamino]-1,3-dihydroindol-2-one
CID 43691683
6-chloro-5-[(1-methylpiperidin-4-yl)methylamino]-1,3-dihydroindol-2-one
CID 62655083
5-[(4-bromophenyl)methylamino]-6-chloro-1,3-dihydroindol-2-one
CID 43691682
3-(tert-butylamino)-N-(6-chloro-2-oxo-1,3-dihydroindol-5-yl)propanamide
CID 60849399
6-chloro-5-(nonan-2-ylamino)-1,3-dihydroindol-2-one
CID 43691740
6-chloro-5-[(3-chloro-5-fluorophenyl)methylamino]-1,3-dihydroindol-2-one
CID 114452412
methyl 2-[(6-chloro-2-oxo-1,3-dihydroindol-5-yl)amino]butanoate
CID 115352612
6-chloro-5-[(1-ethylpiperidin-4-yl)amino]-1,3-dihydroindol-2-one
CID 43691705
6-chloro-5-[(3-methylcyclopentyl)amino]-1,3-dihydroindol-2-one
CID 64502307
6-chloro-5-(pyrimidin-4-ylmethylamino)-1,3-dihydroindol-2-one
CID 62758930
6-chloro-5-(piperidin-3-ylmethylamino)-1,3-dihydroindol-2-one
CID 80553609

Frequently Asked Questions

What is the IUPAC name of 6-chloro-5-(propylamino)-1,3-dihydroindol-2-one?
The IUPAC name of 6-chloro-5-(propylamino)-1,3-dihydroindol-2-one (CID 43691797) is 6-chloro-5-(propylamino)-1,3-dihydroindol-2-one.
What is the SMILES notation for 6-chloro-5-(propylamino)-1,3-dihydroindol-2-one?
The canonical SMILES for 6-chloro-5-(propylamino)-1,3-dihydroindol-2-one is CCCNc1cc2c(cc1Cl)NC(=O)C2.
What is the InChIKey of 6-chloro-5-(propylamino)-1,3-dihydroindol-2-one?
The InChIKey is ZQRACBRDKTZVJX-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H13ClN2O/c1-2-3-13-10-4-7-5-11(15)14-9(7)6-8(10)12/h4,6,13H,2-3,5H2,1H3,(H,14,15).
What are the key properties of 6-chloro-5-(propylamino)-1,3-dihydroindol-2-one?
6-chloro-5-(propylamino)-1,3-dihydroindol-2-one has a molecular weight of 224.69 g/mol, XLogP of 2.66, 3 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 6-chloro-5-(propylamino)-1,3-dihydroindol-2-one is sourced from PubChem (CID 43691797), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).