6-[(5-chloro-2-hydroxyphenyl)methylideneamino]-1,3-dihydroindol-2-one

C15H11ClN2O2 — CID 149279914

IUPAC6-[(5-chloro-2-hydroxyphenyl)methylideneamino]-1,3-dihydroindol-2-one
SMILESO=C1Cc2ccc(/N=C/c3cc(Cl)ccc3O)cc2N1
InChIInChI=1S/C15H11ClN2O2/c16-11-2-4-14(19)10(5-11)8-17-12-3-1-9-6-15(20)18-13(9)7-12/h1-5,7-8,19H,6H2,(H,18,20)/b17-8+
InChIKeyXSTCQZKCAPESIP-CAOOACKPSA-N
MW286.72 g/mol
LogP3.29
Rot. Bonds2

About 6-[(5-chloro-2-hydroxyphenyl)methylideneamino]-1,3-dihydroindol-2-one

6-[(5-chloro-2-hydroxyphenyl)methylideneamino]-1,3-dihydroindol-2-one (PubChem CID 149279914) has the molecular formula C15H11ClN2O2 and a molecular weight of 286.72 g/mol. Its IUPAC name is 6-[(5-chloro-2-hydroxyphenyl)methylideneamino]-1,3-dihydroindol-2-one.

Molecular Properties

Compound Name6-[(5-chloro-2-hydroxyphenyl)methylideneamino]-1,3-dihydroindol-2-one
PubChem CID149279914
Molecular FormulaC15H11ClN2O2
Molecular Weight286.72 g/mol
Exact Mass286.05
IUPAC Name6-[(5-chloro-2-hydroxyphenyl)methylideneamino]-1,3-dihydroindol-2-one
SMILESO=C1Cc2ccc(/N=C/c3cc(Cl)ccc3O)cc2N1
InChIInChI=1S/C15H11ClN2O2/c16-11-2-4-14(19)10(5-11)8-17-12-3-1-9-6-15(20)18-13(9)7-12/h1-5,7-8,19H,6H2,(H,18,20)/b17-8+
InChIKeyXSTCQZKCAPESIP-CAOOACKPSA-N
XLogP3.29
TPSA61.69 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500286.72
LogP ≤ 53.29
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'imine_1', 'substructure': 'N/A'}

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Related Compounds

4-chloro-2-[(4-hydroxyphenyl)iminomethyl]phenol
CID 135757927
6-chloro-1,3-dihydroindol-2-one;hydrate;hydrochloride
CID 86611692
4-[(5-chloro-2-hydroxyphenyl)methylideneamino]benzoic acid
CID 961431
4-chloro-2-[(4-chloro-3-nitrophenyl)iminomethyl]phenol
CID 135595561
4-chloro-2-[(4-fluoro-3-nitrophenyl)iminomethyl]phenol
CID 135595254
4-[(5-chloro-2-hydroxyphenyl)methylideneamino]benzonitrile
CID 135657361
4-chloro-2-[[4-(trifluoromethoxy)phenyl]iminomethyl]phenol
CID 162659279
dimethyl 5-[(5-chloro-2-hydroxyphenyl)methylideneamino]benzene-1,3-dicarboxylate
CID 135595456
2-chloro-5-[(5-chloro-2-hydroxyphenyl)methylideneamino]-N,N-diethylbenzenesulfonamide
CID 135596129
4-chloro-2-[[4-[(5S,7R)-3-phenyl-1-adamantyl]phenyl]iminomethyl]phenol
CID 136897175
4-chloro-2-[(5-methyl-3-pyridinyl)iminomethyl]phenol
CID 139204499
5-[(5-chloro-2-hydroxyphenyl)methylideneamino]-2-methoxy-N,N-dimethylbenzenesulfonamide
CID 135758621

Frequently Asked Questions

What is the IUPAC name of 6-[(5-chloro-2-hydroxyphenyl)methylideneamino]-1,3-dihydroindol-2-one?
The IUPAC name of 6-[(5-chloro-2-hydroxyphenyl)methylideneamino]-1,3-dihydroindol-2-one (CID 149279914) is 6-[(5-chloro-2-hydroxyphenyl)methylideneamino]-1,3-dihydroindol-2-one.
What is the SMILES notation for 6-[(5-chloro-2-hydroxyphenyl)methylideneamino]-1,3-dihydroindol-2-one?
The canonical SMILES for 6-[(5-chloro-2-hydroxyphenyl)methylideneamino]-1,3-dihydroindol-2-one is O=C1Cc2ccc(/N=C/c3cc(Cl)ccc3O)cc2N1.
What is the InChIKey of 6-[(5-chloro-2-hydroxyphenyl)methylideneamino]-1,3-dihydroindol-2-one?
The InChIKey is XSTCQZKCAPESIP-CAOOACKPSA-N. The full InChI is InChI=1S/C15H11ClN2O2/c16-11-2-4-14(19)10(5-11)8-17-12-3-1-9-6-15(20)18-13(9)7-12/h1-5,7-8,19H,6H2,(H,18,20)/b17-8+.
What are the key properties of 6-[(5-chloro-2-hydroxyphenyl)methylideneamino]-1,3-dihydroindol-2-one?
6-[(5-chloro-2-hydroxyphenyl)methylideneamino]-1,3-dihydroindol-2-one has a molecular weight of 286.72 g/mol, XLogP of 3.29, 2 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 6-[(5-chloro-2-hydroxyphenyl)methylideneamino]-1,3-dihydroindol-2-one is sourced from PubChem (CID 149279914), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).