1-methanidyl-2-phenylindolizine;pentakis(vanadium)

C15H12NV5- — CID 58787377

IUPAC1-methanidyl-2-phenylindolizine;pentakis(vanadium)
SMILES[CH2-]c1c(-c2ccccc2)cn2ccccc12.[V].[V].[V].[V].[V]
InChIInChI=1S/C15H12N.5V/c1-12-14(13-7-3-2-4-8-13)11-16-10-6-5-9-15(12)16;;;;;/h2-11H,1H2;;;;;/q-1;;;;;
InChIKeyVXDDDXHCUMZPTE-UHFFFAOYSA-N
MW460.99 g/mol
LogP3.78
Rot. Bonds1

About 1-methanidyl-2-phenylindolizine;pentakis(vanadium)

1-methanidyl-2-phenylindolizine;pentakis(vanadium) (PubChem CID 58787377) has the molecular formula C15H12NV5- and a molecular weight of 460.99 g/mol. Its IUPAC name is 1-methanidyl-2-phenylindolizine;pentakis(vanadium).

Molecular Properties

Compound Name1-methanidyl-2-phenylindolizine;pentakis(vanadium)
PubChem CID58787377
Molecular FormulaC15H12NV5-
Molecular Weight460.99 g/mol
Exact Mass460.82
IUPAC Name1-methanidyl-2-phenylindolizine;pentakis(vanadium)
SMILES[CH2-]c1c(-c2ccccc2)cn2ccccc12.[V].[V].[V].[V].[V]
InChIInChI=1S/C15H12N.5V/c1-12-14(13-7-3-2-4-8-13)11-16-10-6-5-9-15(12)16;;;;;/h2-11H,1H2;;;;;/q-1;;;;;
InChIKeyVXDDDXHCUMZPTE-UHFFFAOYSA-N
XLogP3.78
TPSA4.41 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds1
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500460.99
LogP ≤ 53.78
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

Computed Properties (RDKit)

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

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Related Compounds

2-tert-butyl-1-methanidylindolizine;pentakis(vanadium)
CID 58787372
2-phenyl-1-[3-(2-phenylphenyl)-2-benzofuran-1-yl]indolizine
CID 156552702
2-phenyl-1-[(4-propan-2-ylphenyl)sulfanylmethyl]indolizine
CID 3266120
[4-(1-ethylindolizin-2-yl)phenyl]methanol
CID 18706965
1,4-diphenylpyridazino[4,5-a]indolizine
CID 141114313
methyl 2-(4-chlorophenyl)indolizine-1-carboxylate
CID 122364002
1,1'-biphenyl;indolizin-1-ol
CID 22905672
2-thiophen-2-ylindolizine-1-carboxylic acid
CID 3992519
2-(4-fluorophenyl)-1-(4-fluorophenyl)sulfonylindolizine
CID 20911986
1H-azirino[2,3-a]indolizine
CID 45087425
2-(6-bromo-2,3-dihydro-1,4-benzodioxin-7-yl)indolizine-1-carboxylic acid
CID 3566249
ethyl 2-(4-bromophenyl)indolizine-1-carboxylate
CID 2763725

Frequently Asked Questions

What is the IUPAC name of 1-methanidyl-2-phenylindolizine;pentakis(vanadium)?
The IUPAC name of 1-methanidyl-2-phenylindolizine;pentakis(vanadium) (CID 58787377) is 1-methanidyl-2-phenylindolizine;pentakis(vanadium).
What is the SMILES notation for 1-methanidyl-2-phenylindolizine;pentakis(vanadium)?
The canonical SMILES for 1-methanidyl-2-phenylindolizine;pentakis(vanadium) is [CH2-]c1c(-c2ccccc2)cn2ccccc12.[V].[V].[V].[V].[V].
What is the InChIKey of 1-methanidyl-2-phenylindolizine;pentakis(vanadium)?
The InChIKey is VXDDDXHCUMZPTE-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H12N.5V/c1-12-14(13-7-3-2-4-8-13)11-16-10-6-5-9-15(12)16;;;;;/h2-11H,1H2;;;;;/q-1;;;;;.
What are the key properties of 1-methanidyl-2-phenylindolizine;pentakis(vanadium)?
1-methanidyl-2-phenylindolizine;pentakis(vanadium) has a molecular weight of 460.99 g/mol, XLogP of 3.78, 1 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 1-methanidyl-2-phenylindolizine;pentakis(vanadium) is sourced from PubChem (CID 58787377), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).