6-chloro-3-[(4-chlorophenyl)methylidene]-1,2-dihydroindole

C15H11Cl2N — CID 91560014

IUPAC6-chloro-3-[(4-chlorophenyl)methylidene]-1,2-dihydroindole
SMILESClc1ccc(C=C2CNc3cc(Cl)ccc32)cc1
InChIInChI=1S/C15H11Cl2N/c16-12-3-1-10(2-4-12)7-11-9-18-15-8-13(17)5-6-14(11)15/h1-8,18H,9H2
InChIKeyDLXGFAWJMHRJSU-UHFFFAOYSA-N
MW276.17 g/mol
LogP4.96
Rot. Bonds1

About 6-chloro-3-[(4-chlorophenyl)methylidene]-1,2-dihydroindole

6-chloro-3-[(4-chlorophenyl)methylidene]-1,2-dihydroindole (PubChem CID 91560014) has the molecular formula C15H11Cl2N and a molecular weight of 276.17 g/mol. Its IUPAC name is 6-chloro-3-[(4-chlorophenyl)methylidene]-1,2-dihydroindole.

Molecular Properties

Compound Name6-chloro-3-[(4-chlorophenyl)methylidene]-1,2-dihydroindole
PubChem CID91560014
Molecular FormulaC15H11Cl2N
Molecular Weight276.17 g/mol
Exact Mass275.03
IUPAC Name6-chloro-3-[(4-chlorophenyl)methylidene]-1,2-dihydroindole
SMILESClc1ccc(C=C2CNc3cc(Cl)ccc32)cc1
InChIInChI=1S/C15H11Cl2N/c16-12-3-1-10(2-4-12)7-11-9-18-15-8-13(17)5-6-14(11)15/h1-8,18H,9H2
InChIKeyDLXGFAWJMHRJSU-UHFFFAOYSA-N
XLogP4.96
TPSA12.03 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds1
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500276.17
LogP ≤ 54.96
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

Computed Properties (RDKit)

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

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Related Compounds

6-chloro-3-[(3-chlorophenyl)methylidene]-1,2-dihydroindole
CID 91397746
3-[(4-chlorophenyl)methylidene]azetidine
CID 79879268
7-chloro-4,5-dihydro-[1,3]thiazolo[5,4-c]quinoline
CID 96606057
(NZ)-N-[2-[(4-chlorophenyl)methylidene]cyclohexylidene]hydroxylamine
CID 5464792
(2E)-2,5-bis[(4-chlorophenyl)methylidene]cyclopentan-1-one
CID 694487
4-[(E)-(6-chloro-2-oxo-1H-indol-3-ylidene)methyl]benzaldehyde
CID 90683183
(3Z,5Z)-3,5-bis[(4-chlorophenyl)methylidene]-1,1-dioxothian-4-one
CID 124635641
3-[(E)-(5-chloro-2,3-dihydroinden-1-ylidene)methyl]pyridine
CID 6539765
(2Z)-2-[(4-chlorophenyl)methylidene]cyclohexan-1-one
CID 6450877
4-chloro-2-[(4-chlorophenyl)methylidene]-3H-inden-1-one
CID 175440685
(3Z)-3-benzylidene-6-chloro-1H-indol-2-one
CID 962904
(2E)-2-[(4-chlorophenyl)methylidene]-5-methoxy-3H-inden-1-one
CID 58855563

Frequently Asked Questions

What is the IUPAC name of 6-chloro-3-[(4-chlorophenyl)methylidene]-1,2-dihydroindole?
The IUPAC name of 6-chloro-3-[(4-chlorophenyl)methylidene]-1,2-dihydroindole (CID 91560014) is 6-chloro-3-[(4-chlorophenyl)methylidene]-1,2-dihydroindole.
What is the SMILES notation for 6-chloro-3-[(4-chlorophenyl)methylidene]-1,2-dihydroindole?
The canonical SMILES for 6-chloro-3-[(4-chlorophenyl)methylidene]-1,2-dihydroindole is Clc1ccc(C=C2CNc3cc(Cl)ccc32)cc1.
What is the InChIKey of 6-chloro-3-[(4-chlorophenyl)methylidene]-1,2-dihydroindole?
The InChIKey is DLXGFAWJMHRJSU-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H11Cl2N/c16-12-3-1-10(2-4-12)7-11-9-18-15-8-13(17)5-6-14(11)15/h1-8,18H,9H2.
What are the key properties of 6-chloro-3-[(4-chlorophenyl)methylidene]-1,2-dihydroindole?
6-chloro-3-[(4-chlorophenyl)methylidene]-1,2-dihydroindole has a molecular weight of 276.17 g/mol, XLogP of 4.96, 1 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 6-chloro-3-[(4-chlorophenyl)methylidene]-1,2-dihydroindole is sourced from PubChem (CID 91560014), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).