(E)-1-(1H-inden-5-yl)-N-[(E)-1H-indol-5-ylmethylideneamino]methanimine

C19H15N3 — CID 118543204

IUPAC(E)-1-(1H-inden-5-yl)-N-[(E)-1H-indol-5-ylmethylideneamino]methanimine
SMILESC1=Cc2cc(/C=N/N=C/c3ccc4[nH]ccc4c3)ccc2C1
InChIInChI=1S/C19H15N3/c1-2-16-6-4-14(10-17(16)3-1)12-21-22-13-15-5-7-19-18(11-15)8-9-20-19/h1,3-13,20H,2H2/b21-12+,22-13+
InChIKeyDWWSXZNQISWYMO-ADYPVIEZSA-N
MW285.35 g/mol
LogP4.19
Rot. Bonds3

About (E)-1-(1H-inden-5-yl)-N-[(E)-1H-indol-5-ylmethylideneamino]methanimine

(E)-1-(1H-inden-5-yl)-N-[(E)-1H-indol-5-ylmethylideneamino]methanimine (PubChem CID 118543204) has the molecular formula C19H15N3 and a molecular weight of 285.35 g/mol. Its IUPAC name is (E)-1-(1H-inden-5-yl)-N-[(E)-1H-indol-5-ylmethylideneamino]methanimine.

Molecular Properties

Compound Name(E)-1-(1H-inden-5-yl)-N-[(E)-1H-indol-5-ylmethylideneamino]methanimine
PubChem CID118543204
Molecular FormulaC19H15N3
Molecular Weight285.35 g/mol
Exact Mass285.13
IUPAC Name(E)-1-(1H-inden-5-yl)-N-[(E)-1H-indol-5-ylmethylideneamino]methanimine
SMILESC1=Cc2cc(/C=N/N=C/c3ccc4[nH]ccc4c3)ccc2C1
InChIInChI=1S/C19H15N3/c1-2-16-6-4-14(10-17(16)3-1)12-21-22-13-15-5-7-19-18(11-15)8-9-20-19/h1,3-13,20H,2H2/b21-12+,22-13+
InChIKeyDWWSXZNQISWYMO-ADYPVIEZSA-N
XLogP4.19
TPSA40.51 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500285.35
LogP ≤ 54.19
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

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

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Frequently Asked Questions

What is the IUPAC name of (E)-1-(1H-inden-5-yl)-N-[(E)-1H-indol-5-ylmethylideneamino]methanimine?
The IUPAC name of (E)-1-(1H-inden-5-yl)-N-[(E)-1H-indol-5-ylmethylideneamino]methanimine (CID 118543204) is (E)-1-(1H-inden-5-yl)-N-[(E)-1H-indol-5-ylmethylideneamino]methanimine.
What is the SMILES notation for (E)-1-(1H-inden-5-yl)-N-[(E)-1H-indol-5-ylmethylideneamino]methanimine?
The canonical SMILES for (E)-1-(1H-inden-5-yl)-N-[(E)-1H-indol-5-ylmethylideneamino]methanimine is C1=Cc2cc(/C=N/N=C/c3ccc4[nH]ccc4c3)ccc2C1.
What is the InChIKey of (E)-1-(1H-inden-5-yl)-N-[(E)-1H-indol-5-ylmethylideneamino]methanimine?
The InChIKey is DWWSXZNQISWYMO-ADYPVIEZSA-N. The full InChI is InChI=1S/C19H15N3/c1-2-16-6-4-14(10-17(16)3-1)12-21-22-13-15-5-7-19-18(11-15)8-9-20-19/h1,3-13,20H,2H2/b21-12+,22-13+.
What are the key properties of (E)-1-(1H-inden-5-yl)-N-[(E)-1H-indol-5-ylmethylideneamino]methanimine?
(E)-1-(1H-inden-5-yl)-N-[(E)-1H-indol-5-ylmethylideneamino]methanimine has a molecular weight of 285.35 g/mol, XLogP of 4.19, 3 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for (E)-1-(1H-inden-5-yl)-N-[(E)-1H-indol-5-ylmethylideneamino]methanimine is sourced from PubChem (CID 118543204), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).