5-(2-chloro-3-cyclopropyloxyphenyl)-1,3-dihydroindol-2-one

C17H14ClNO2 — CID 122655643

IUPAC5-(2-chloro-3-cyclopropyloxyphenyl)-1,3-dihydroindol-2-one
SMILESO=C1Cc2cc(-c3cccc(OC4CC4)c3Cl)ccc2N1
InChIInChI=1S/C17H14ClNO2/c18-17-13(2-1-3-15(17)21-12-5-6-12)10-4-7-14-11(8-10)9-16(20)19-14/h1-4,7-8,12H,5-6,9H2,(H,19,20)
InChIKeyWBVMIYXORDEQOP-UHFFFAOYSA-N
MW299.76 g/mol
LogP4.04
Rot. Bonds3

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

5-(2-chloro-3-cyclopropyloxyphenyl)-1,3-dihydroindol-2-one (PubChem CID 122655643) has the molecular formula C17H14ClNO2 and a molecular weight of 299.76 g/mol. Its IUPAC name is 5-(2-chloro-3-cyclopropyloxyphenyl)-1,3-dihydroindol-2-one.

Molecular Properties

Compound Name5-(2-chloro-3-cyclopropyloxyphenyl)-1,3-dihydroindol-2-one
PubChem CID122655643
Molecular FormulaC17H14ClNO2
Molecular Weight299.76 g/mol
Exact Mass299.07
IUPAC Name5-(2-chloro-3-cyclopropyloxyphenyl)-1,3-dihydroindol-2-one
SMILESO=C1Cc2cc(-c3cccc(OC4CC4)c3Cl)ccc2N1
InChIInChI=1S/C17H14ClNO2/c18-17-13(2-1-3-15(17)21-12-5-6-12)10-4-7-14-11(8-10)9-16(20)19-14/h1-4,7-8,12H,5-6,9H2,(H,19,20)
InChIKeyWBVMIYXORDEQOP-UHFFFAOYSA-N
XLogP4.04
TPSA38.33 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500299.76
LogP ≤ 54.04
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

5-[2-chloro-6-(difluoromethoxy)phenyl]-1,3-dihydroindol-2-one
CID 122655642
5-(2-chloro-6-phenylphenyl)-1,3-dihydroindol-2-one
CID 122655598
6-(2-chloro-3-methylphenyl)-3,4-dihydro-1H-quinolin-2-one
CID 167292467
5-(2,4,6-trichlorophenyl)-1,3-dihydroindol-2-one
CID 147482882
4-[3-chloro-2-(2-oxo-1,3-dihydroindol-5-yl)phenyl]benzonitrile
CID 122655667
6-(2,3-dimethoxyphenyl)-1,3-dihydroindol-2-one
CID 90833964
4-chloro-3-(2-oxo-1,3-dihydroindol-5-yl)benzoic acid
CID 146216092
2-cyclohexyloxy-N-(2-oxo-1,3-dihydroindol-5-yl)benzamide
CID 154838654
2-[3-chloro-2-(2-oxo-1,3-dihydroindol-5-yl)phenyl]acetonitrile
CID 122655715
5-[2-methyl-3-(pyrrolidin-1-ylmethyl)phenyl]-1,3-dihydroindol-2-one
CID 162045284
5-thiophen-2-yl-1,3-dihydroindol-2-one
CID 16637508
5-(2-methyl-5-sulfanylphenyl)-1,3-dihydroindol-2-one
CID 146227564

Frequently Asked Questions

What is the IUPAC name of 5-(2-chloro-3-cyclopropyloxyphenyl)-1,3-dihydroindol-2-one?
The IUPAC name of 5-(2-chloro-3-cyclopropyloxyphenyl)-1,3-dihydroindol-2-one (CID 122655643) is 5-(2-chloro-3-cyclopropyloxyphenyl)-1,3-dihydroindol-2-one.
What is the SMILES notation for 5-(2-chloro-3-cyclopropyloxyphenyl)-1,3-dihydroindol-2-one?
The canonical SMILES for 5-(2-chloro-3-cyclopropyloxyphenyl)-1,3-dihydroindol-2-one is O=C1Cc2cc(-c3cccc(OC4CC4)c3Cl)ccc2N1.
What is the InChIKey of 5-(2-chloro-3-cyclopropyloxyphenyl)-1,3-dihydroindol-2-one?
The InChIKey is WBVMIYXORDEQOP-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H14ClNO2/c18-17-13(2-1-3-15(17)21-12-5-6-12)10-4-7-14-11(8-10)9-16(20)19-14/h1-4,7-8,12H,5-6,9H2,(H,19,20).
What are the key properties of 5-(2-chloro-3-cyclopropyloxyphenyl)-1,3-dihydroindol-2-one?
5-(2-chloro-3-cyclopropyloxyphenyl)-1,3-dihydroindol-2-one has a molecular weight of 299.76 g/mol, XLogP of 4.04, 3 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 5-(2-chloro-3-cyclopropyloxyphenyl)-1,3-dihydroindol-2-one is sourced from PubChem (CID 122655643), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).