dimethyl-[(2E)-2-(1,3,3-trimethylindol-2-ylidene)ethylidene]azanium

C15H21N2+ — CID 18526952

IUPACdimethyl-[(2E)-2-(1,3,3-trimethylindol-2-ylidene)ethylidene]azanium
SMILESCN1/C(=C/C=[N+](C)C)C(C)(C)c2ccccc21
InChIInChI=1S/C15H21N2/c1-15(2)12-8-6-7-9-13(12)17(5)14(15)10-11-16(3)4/h6-11H,1-5H3/q+1
InChIKeyBGBICWOROGIHNB-UHFFFAOYSA-N
MW229.35 g/mol
LogP2.64
Rot. Bonds1

About dimethyl-[(2E)-2-(1,3,3-trimethylindol-2-ylidene)ethylidene]azanium

dimethyl-[(2E)-2-(1,3,3-trimethylindol-2-ylidene)ethylidene]azanium (PubChem CID 18526952) has the molecular formula C15H21N2+ and a molecular weight of 229.35 g/mol. Its IUPAC name is dimethyl-[(2E)-2-(1,3,3-trimethylindol-2-ylidene)ethylidene]azanium.

Molecular Properties

Compound Namedimethyl-[(2E)-2-(1,3,3-trimethylindol-2-ylidene)ethylidene]azanium
PubChem CID18526952
Molecular FormulaC15H21N2+
Molecular Weight229.35 g/mol
Exact Mass229.17
IUPAC Namedimethyl-[(2E)-2-(1,3,3-trimethylindol-2-ylidene)ethylidene]azanium
SMILESCN1/C(=C/C=[N+](C)C)C(C)(C)c2ccccc21
InChIInChI=1S/C15H21N2/c1-15(2)12-8-6-7-9-13(12)17(5)14(15)10-11-16(3)4/h6-11H,1-5H3/q+1
InChIKeyBGBICWOROGIHNB-UHFFFAOYSA-N
XLogP2.64
TPSA6.25 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds1
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500229.35
LogP ≤ 52.64
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'imine_1', 'substructure': 'N/A'}, {'alert_name': 'quaternary_nitrogen_1', 'substructure': 'N/A'}

Analyze dimethyl-[(2E)-2-(1,3,3-trimethylindol-2-ylidene)ethylidene]azanium with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

dimethyl-[2-(1,3,3-trimethylindol-2-ylidene)ethylidene]azanium perchlorate
CID 73448945
dimethyl-[6-(1,3,3-trimethylindol-2-ylidene)hexa-2,4-dienylidene]azanium
CID 2770749
(2Z)-1,3,3-trimethyl-2-[(2E)-2-(1,3,3-trimethylindol-2-ylidene)ethylidene]indole
CID 18806794
(4-methoxyphenyl)-methyl-[2-(1,3,3-trimethylindol-2-ylidene)ethylidene]azanium
CID 72728773
[(2E)-2-(1-cyclopentyl-3,3-dimethylindol-2-ylidene)ethylidene]-dimethylazanium
CID 59004899
dimethyl-[2-[1-methyl-3,3-bis(2-methylpropyl)indol-2-ylidene]ethylidene]azanium
CID 173352351
9,9,10-trimethylacridine
CID 610451
1,3,3-trimethyl-2-(nitrosomethylidene)indole
CID 4625557
diphenyl-[(2E,5E)-5-[(2Z)-2-(1,3,3-trimethylindol-2-ylidene)ethylidene]-2-[(2E)-2-(1,3,3-trimethylindol-2-ylidene)ethylidene]cyclopentylidene]azanium
CID 76844547
(2Z)-N-(4-phenyldiazenylphenyl)-2-(1,3,3-trimethylindol-2-ylidene)ethanimine
CID 30223942
dimethyl-[(2E,6E)-2-[(2Z)-2-(1,3,3-trimethylindol-2-ylidene)ethylidene]-6-[(2E)-2-(1,3,3-trimethylindol-2-ylidene)ethylidene]cyclohexylidene]azanium tetrafluoroborate
CID 154726459
(2Z)-N-pyridin-4-yl-2-(1,3,3-trimethylindol-2-ylidene)ethanimine
CID 21179247

Frequently Asked Questions

What is the IUPAC name of dimethyl-[(2E)-2-(1,3,3-trimethylindol-2-ylidene)ethylidene]azanium?
The IUPAC name of dimethyl-[(2E)-2-(1,3,3-trimethylindol-2-ylidene)ethylidene]azanium (CID 18526952) is dimethyl-[(2E)-2-(1,3,3-trimethylindol-2-ylidene)ethylidene]azanium.
What is the SMILES notation for dimethyl-[(2E)-2-(1,3,3-trimethylindol-2-ylidene)ethylidene]azanium?
The canonical SMILES for dimethyl-[(2E)-2-(1,3,3-trimethylindol-2-ylidene)ethylidene]azanium is CN1/C(=C/C=[N+](C)C)C(C)(C)c2ccccc21.
What is the InChIKey of dimethyl-[(2E)-2-(1,3,3-trimethylindol-2-ylidene)ethylidene]azanium?
The InChIKey is BGBICWOROGIHNB-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H21N2/c1-15(2)12-8-6-7-9-13(12)17(5)14(15)10-11-16(3)4/h6-11H,1-5H3/q+1.
What are the key properties of dimethyl-[(2E)-2-(1,3,3-trimethylindol-2-ylidene)ethylidene]azanium?
dimethyl-[(2E)-2-(1,3,3-trimethylindol-2-ylidene)ethylidene]azanium has a molecular weight of 229.35 g/mol, XLogP of 2.64, 1 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for dimethyl-[(2E)-2-(1,3,3-trimethylindol-2-ylidene)ethylidene]azanium is sourced from PubChem (CID 18526952), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).