N-(1H-indol-3-yl)-1-[2-(1H-indol-3-yliminomethyl)phenyl]methanimine

C24H18N4 — CID 66551006

IUPACN-(1H-indol-3-yl)-1-[2-(1H-indol-3-yliminomethyl)phenyl]methanimine
SMILESC(=N/c1c[nH]c2ccccc12)\c1ccccc1/C=N/c1c[nH]c2ccccc12
InChIInChI=1S/C24H18N4/c1-2-8-18(14-26-24-16-28-22-12-6-4-10-20(22)24)17(7-1)13-25-23-15-27-21-11-5-3-9-19(21)23/h1-16,27-28H/b25-13+,26-14+
InChIKeyGAXURITWYQDMTR-BKHCZYBLSA-N
MW362.44 g/mol
LogP6.15
Rot. Bonds4

About N-(1H-indol-3-yl)-1-[2-(1H-indol-3-yliminomethyl)phenyl]methanimine

N-(1H-indol-3-yl)-1-[2-(1H-indol-3-yliminomethyl)phenyl]methanimine (PubChem CID 66551006) has the molecular formula C24H18N4 and a molecular weight of 362.44 g/mol. Its IUPAC name is N-(1H-indol-3-yl)-1-[2-(1H-indol-3-yliminomethyl)phenyl]methanimine.

Molecular Properties

Compound NameN-(1H-indol-3-yl)-1-[2-(1H-indol-3-yliminomethyl)phenyl]methanimine
PubChem CID66551006
Molecular FormulaC24H18N4
Molecular Weight362.44 g/mol
Exact Mass362.15
IUPAC NameN-(1H-indol-3-yl)-1-[2-(1H-indol-3-yliminomethyl)phenyl]methanimine
SMILESC(=N/c1c[nH]c2ccccc12)\c1ccccc1/C=N/c1c[nH]c2ccccc12
InChIInChI=1S/C24H18N4/c1-2-8-18(14-26-24-16-28-22-12-6-4-10-20(22)24)17(7-1)13-25-23-15-27-21-11-5-3-9-19(21)23/h1-16,27-28H/b25-13+,26-14+
InChIKeyGAXURITWYQDMTR-BKHCZYBLSA-N
XLogP6.15
TPSA56.30 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms28
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500362.44
LogP ≤ 56.15
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

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

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Related Compounds

2-(1H-indol-3-ylmethylideneamino)benzonitrile
CID 686965
N-(2,5-dimethylphenyl)-1-(1H-indol-3-yl)methanimine
CID 693741
1-(1H-indol-3-yl)-N-[4-[2-[4-(1H-indol-3-ylmethylideneamino)phenyl]ethyl]phenyl]methanimine
CID 177388523
1-(1H-indol-3-yl)-N-(4-propan-2-ylphenyl)methanimine
CID 3459519
[3-(1H-indol-3-ylmethylideneamino)phenyl]methanol
CID 681868
N-[2-(1H-indol-3-ylmethylideneamino)phenyl]-4-methylbenzenesulfonamide
CID 1379937
1-(1H-indol-7-yl)-N-naphthalen-1-ylmethanimine
CID 23578067
1H-indol-3-yl-(4-nitrophenyl)diazene
CID 135447734
N-[(E)-1H-indol-3-ylmethylideneamino]-N'-[(Z)-1H-indol-3-ylmethylideneamino]butanediamide
CID 136861417
(E)-1-(1H-indol-3-yl)-N-piperidin-1-ylmethanimine
CID 135675955
N-(1H-indol-3-ylmethylideneamino)-N'-[(E)-1H-indol-3-ylmethylideneamino]oxamide
CID 135810504
1-(1H-indol-3-yl)-N-quinolin-6-ylmethanimine
CID 3742458

Frequently Asked Questions

What is the IUPAC name of N-(1H-indol-3-yl)-1-[2-(1H-indol-3-yliminomethyl)phenyl]methanimine?
The IUPAC name of N-(1H-indol-3-yl)-1-[2-(1H-indol-3-yliminomethyl)phenyl]methanimine (CID 66551006) is N-(1H-indol-3-yl)-1-[2-(1H-indol-3-yliminomethyl)phenyl]methanimine.
What is the SMILES notation for N-(1H-indol-3-yl)-1-[2-(1H-indol-3-yliminomethyl)phenyl]methanimine?
The canonical SMILES for N-(1H-indol-3-yl)-1-[2-(1H-indol-3-yliminomethyl)phenyl]methanimine is C(=N/c1c[nH]c2ccccc12)\c1ccccc1/C=N/c1c[nH]c2ccccc12.
What is the InChIKey of N-(1H-indol-3-yl)-1-[2-(1H-indol-3-yliminomethyl)phenyl]methanimine?
The InChIKey is GAXURITWYQDMTR-BKHCZYBLSA-N. The full InChI is InChI=1S/C24H18N4/c1-2-8-18(14-26-24-16-28-22-12-6-4-10-20(22)24)17(7-1)13-25-23-15-27-21-11-5-3-9-19(21)23/h1-16,27-28H/b25-13+,26-14+.
What are the key properties of N-(1H-indol-3-yl)-1-[2-(1H-indol-3-yliminomethyl)phenyl]methanimine?
N-(1H-indol-3-yl)-1-[2-(1H-indol-3-yliminomethyl)phenyl]methanimine has a molecular weight of 362.44 g/mol, XLogP of 6.15, 4 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-(1H-indol-3-yl)-1-[2-(1H-indol-3-yliminomethyl)phenyl]methanimine is sourced from PubChem (CID 66551006), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).