3-amino-6-chloro-1,3-dihydroindol-2-one;hydrochloride

C8H8Cl2N2O — CID 43810830

IUPAC3-amino-6-chloro-1,3-dihydroindol-2-one;hydrochloride
SMILESCl.NC1C(=O)Nc2cc(Cl)ccc21
InChIInChI=1S/C8H7ClN2O.ClH/c9-4-1-2-5-6(3-4)11-8(12)7(5)10;/h1-3,7H,10H2,(H,11,12);1H
InChIKeyGXCFJQQMTAKLAQ-UHFFFAOYSA-N
MW219.07 g/mol
LogP1.71
Rot. Bonds

About 3-amino-6-chloro-1,3-dihydroindol-2-one;hydrochloride

3-amino-6-chloro-1,3-dihydroindol-2-one;hydrochloride (PubChem CID 43810830) has the molecular formula C8H8Cl2N2O and a molecular weight of 219.07 g/mol. Its IUPAC name is 3-amino-6-chloro-1,3-dihydroindol-2-one;hydrochloride.

Molecular Properties

Compound Name3-amino-6-chloro-1,3-dihydroindol-2-one;hydrochloride
PubChem CID43810830
Molecular FormulaC8H8Cl2N2O
Molecular Weight219.07 g/mol
Exact Mass218.00
IUPAC Name3-amino-6-chloro-1,3-dihydroindol-2-one;hydrochloride
SMILESCl.NC1C(=O)Nc2cc(Cl)ccc21
InChIInChI=1S/C8H7ClN2O.ClH/c9-4-1-2-5-6(3-4)11-8(12)7(5)10;/h1-3,7H,10H2,(H,11,12);1H
InChIKeyGXCFJQQMTAKLAQ-UHFFFAOYSA-N
XLogP1.71
TPSA55.12 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500219.07
LogP ≤ 51.71
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 3-amino-6-chloro-1,3-dihydroindol-2-one;hydrochloride?
The IUPAC name of 3-amino-6-chloro-1,3-dihydroindol-2-one;hydrochloride (CID 43810830) is 3-amino-6-chloro-1,3-dihydroindol-2-one;hydrochloride.
What is the SMILES notation for 3-amino-6-chloro-1,3-dihydroindol-2-one;hydrochloride?
The canonical SMILES for 3-amino-6-chloro-1,3-dihydroindol-2-one;hydrochloride is Cl.NC1C(=O)Nc2cc(Cl)ccc21.
What is the InChIKey of 3-amino-6-chloro-1,3-dihydroindol-2-one;hydrochloride?
The InChIKey is GXCFJQQMTAKLAQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H7ClN2O.ClH/c9-4-1-2-5-6(3-4)11-8(12)7(5)10;/h1-3,7H,10H2,(H,11,12);1H.
What are the key properties of 3-amino-6-chloro-1,3-dihydroindol-2-one;hydrochloride?
3-amino-6-chloro-1,3-dihydroindol-2-one;hydrochloride has a molecular weight of 219.07 g/mol, XLogP of 1.71, 0 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 3-amino-6-chloro-1,3-dihydroindol-2-one;hydrochloride is sourced from PubChem (CID 43810830), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).