magnesium 2-[(Z)-2H-pyrrol-1-id-5-ylidenemethyl]-5-[(Z)-[(5Z)-5-(pyrrol-1-id-2-ylmethylidene)pyrrol-1-id-2-ylidene]methyl]pyrrol-1-ide

C19H14MgN4-2 — CID 139592091

IUPACmagnesium 2-[(Z)-2H-pyrrol-1-id-5-ylidenemethyl]-5-[(Z)-[(5Z)-5-(pyrrol-1-id-2-ylmethylidene)pyrrol-1-id-2-ylidene]methyl]pyrrol-1-ide
SMILESC1=C/C(=C/c2ccc(/C=c3/cc/c(=C/c4ccc[n-]4)[n-]3)[n-]2)[N-]C1.[Mg+2]
InChIInChI=1S/C19H14N4.Mg/c1-3-14(20-9-1)11-16-5-7-18(22-16)13-19-8-6-17(23-19)12-15-4-2-10-21-15;/h1-9,11-13H,10H2;/q-4;+2/b15-12-,16-11-,18-13-;
InChIKeyUMVLVFPIXXDKDT-IVCUGXOPSA-N
MW322.65 g/mol
LogP1.12
Rot. Bonds3

About magnesium 2-[(Z)-2H-pyrrol-1-id-5-ylidenemethyl]-5-[(Z)-[(5Z)-5-(pyrrol-1-id-2-ylmethylidene)pyrrol-1-id-2-ylidene]methyl]pyrrol-1-ide

magnesium 2-[(Z)-2H-pyrrol-1-id-5-ylidenemethyl]-5-[(Z)-[(5Z)-5-(pyrrol-1-id-2-ylmethylidene)pyrrol-1-id-2-ylidene]methyl]pyrrol-1-ide (PubChem CID 139592091) has the molecular formula C19H14MgN4-2 and a molecular weight of 322.65 g/mol. Its IUPAC name is magnesium 2-[(Z)-2H-pyrrol-1-id-5-ylidenemethyl]-5-[(Z)-[(5Z)-5-(pyrrol-1-id-2-ylmethylidene)pyrrol-1-id-2-ylidene]methyl]pyrrol-1-ide.

Molecular Properties

Compound Namemagnesium 2-[(Z)-2H-pyrrol-1-id-5-ylidenemethyl]-5-[(Z)-[(5Z)-5-(pyrrol-1-id-2-ylmethylidene)pyrrol-1-id-2-ylidene]methyl]pyrrol-1-ide
PubChem CID139592091
Molecular FormulaC19H14MgN4-2
Molecular Weight322.65 g/mol
Exact Mass322.11
IUPAC Namemagnesium 2-[(Z)-2H-pyrrol-1-id-5-ylidenemethyl]-5-[(Z)-[(5Z)-5-(pyrrol-1-id-2-ylmethylidene)pyrrol-1-id-2-ylidene]methyl]pyrrol-1-ide
SMILESC1=C/C(=C/c2ccc(/C=c3/cc/c(=C/c4ccc[n-]4)[n-]3)[n-]2)[N-]C1.[Mg+2]
InChIInChI=1S/C19H14N4.Mg/c1-3-14(20-9-1)11-16-5-7-18(22-16)13-19-8-6-17(23-19)12-15-4-2-10-21-15;/h1-9,11-13H,10H2;/q-4;+2/b15-12-,16-11-,18-13-;
InChIKeyUMVLVFPIXXDKDT-IVCUGXOPSA-N
XLogP1.12
TPSA56.40 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds3
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500322.65
LogP ≤ 51.12
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 100

Analyze magnesium 2-[(Z)-2H-pyrrol-1-id-5-ylidenemethyl]-5-[(Z)-[(5Z)-5-(pyrrol-1-id-2-ylmethylidene)pyrrol-1-id-2-ylidene]methyl]pyrrol-1-ide with MolForge

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Frequently Asked Questions

What is the IUPAC name of magnesium 2-[(Z)-2H-pyrrol-1-id-5-ylidenemethyl]-5-[(Z)-[(5Z)-5-(pyrrol-1-id-2-ylmethylidene)pyrrol-1-id-2-ylidene]methyl]pyrrol-1-ide?
The IUPAC name of magnesium 2-[(Z)-2H-pyrrol-1-id-5-ylidenemethyl]-5-[(Z)-[(5Z)-5-(pyrrol-1-id-2-ylmethylidene)pyrrol-1-id-2-ylidene]methyl]pyrrol-1-ide (CID 139592091) is magnesium 2-[(Z)-2H-pyrrol-1-id-5-ylidenemethyl]-5-[(Z)-[(5Z)-5-(pyrrol-1-id-2-ylmethylidene)pyrrol-1-id-2-ylidene]methyl]pyrrol-1-ide.
What is the SMILES notation for magnesium 2-[(Z)-2H-pyrrol-1-id-5-ylidenemethyl]-5-[(Z)-[(5Z)-5-(pyrrol-1-id-2-ylmethylidene)pyrrol-1-id-2-ylidene]methyl]pyrrol-1-ide?
The canonical SMILES for magnesium 2-[(Z)-2H-pyrrol-1-id-5-ylidenemethyl]-5-[(Z)-[(5Z)-5-(pyrrol-1-id-2-ylmethylidene)pyrrol-1-id-2-ylidene]methyl]pyrrol-1-ide is C1=C/C(=C/c2ccc(/C=c3/cc/c(=C/c4ccc[n-]4)[n-]3)[n-]2)[N-]C1.[Mg+2].
What is the InChIKey of magnesium 2-[(Z)-2H-pyrrol-1-id-5-ylidenemethyl]-5-[(Z)-[(5Z)-5-(pyrrol-1-id-2-ylmethylidene)pyrrol-1-id-2-ylidene]methyl]pyrrol-1-ide?
The InChIKey is UMVLVFPIXXDKDT-IVCUGXOPSA-N. The full InChI is InChI=1S/C19H14N4.Mg/c1-3-14(20-9-1)11-16-5-7-18(22-16)13-19-8-6-17(23-19)12-15-4-2-10-21-15;/h1-9,11-13H,10H2;/q-4;+2/b15-12-,16-11-,18-13-;.
What are the key properties of magnesium 2-[(Z)-2H-pyrrol-1-id-5-ylidenemethyl]-5-[(Z)-[(5Z)-5-(pyrrol-1-id-2-ylmethylidene)pyrrol-1-id-2-ylidene]methyl]pyrrol-1-ide?
magnesium 2-[(Z)-2H-pyrrol-1-id-5-ylidenemethyl]-5-[(Z)-[(5Z)-5-(pyrrol-1-id-2-ylmethylidene)pyrrol-1-id-2-ylidene]methyl]pyrrol-1-ide has a molecular weight of 322.65 g/mol, XLogP of 1.12, 3 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for magnesium 2-[(Z)-2H-pyrrol-1-id-5-ylidenemethyl]-5-[(Z)-[(5Z)-5-(pyrrol-1-id-2-ylmethylidene)pyrrol-1-id-2-ylidene]methyl]pyrrol-1-ide is sourced from PubChem (CID 139592091), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).