bis(1-N,2-N-dimethylcyclopenta-2,5-diene-1,2-diamine);tungsten(2+)

C14H22N4W — CID 58399755

IUPACbis(1-N,2-N-dimethylcyclopenta-2,5-diene-1,2-diamine);tungsten(2+)
SMILESCNC1=[C-]CC=C1NC.CNC1=[C-]CC=C1NC.[W+2]
InChIInChI=1S/2C7H11N2.W/c2*1-8-6-4-3-5-7(6)9-2;/h2*4,8-9H,3H2,1-2H3;/q2*-1;+2
InChIKeyOFCINXUHHPWCKH-UHFFFAOYSA-N
MW430.20 g/mol
LogP0.80
Rot. Bonds4

About bis(1-N,2-N-dimethylcyclopenta-2,5-diene-1,2-diamine);tungsten(2+)

bis(1-N,2-N-dimethylcyclopenta-2,5-diene-1,2-diamine);tungsten(2+) (PubChem CID 58399755) has the molecular formula C14H22N4W and a molecular weight of 430.20 g/mol. Its IUPAC name is bis(1-N,2-N-dimethylcyclopenta-2,5-diene-1,2-diamine);tungsten(2+).

Molecular Properties

Compound Namebis(1-N,2-N-dimethylcyclopenta-2,5-diene-1,2-diamine);tungsten(2+)
PubChem CID58399755
Molecular FormulaC14H22N4W
Molecular Weight430.20 g/mol
Exact Mass430.14
IUPAC Namebis(1-N,2-N-dimethylcyclopenta-2,5-diene-1,2-diamine);tungsten(2+)
SMILESCNC1=[C-]CC=C1NC.CNC1=[C-]CC=C1NC.[W+2]
InChIInChI=1S/2C7H11N2.W/c2*1-8-6-4-3-5-7(6)9-2;/h2*4,8-9H,3H2,1-2H3;/q2*-1;+2
InChIKeyOFCINXUHHPWCKH-UHFFFAOYSA-N
XLogP0.80
TPSA48.12 Ų
H-Bond Donors4
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500430.20
LogP ≤ 50.80
H-Bond Donors ≤ 54
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

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

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Frequently Asked Questions

What is the IUPAC name of bis(1-N,2-N-dimethylcyclopenta-2,5-diene-1,2-diamine);tungsten(2+)?
The IUPAC name of bis(1-N,2-N-dimethylcyclopenta-2,5-diene-1,2-diamine);tungsten(2+) (CID 58399755) is bis(1-N,2-N-dimethylcyclopenta-2,5-diene-1,2-diamine);tungsten(2+).
What is the SMILES notation for bis(1-N,2-N-dimethylcyclopenta-2,5-diene-1,2-diamine);tungsten(2+)?
The canonical SMILES for bis(1-N,2-N-dimethylcyclopenta-2,5-diene-1,2-diamine);tungsten(2+) is CNC1=[C-]CC=C1NC.CNC1=[C-]CC=C1NC.[W+2].
What is the InChIKey of bis(1-N,2-N-dimethylcyclopenta-2,5-diene-1,2-diamine);tungsten(2+)?
The InChIKey is OFCINXUHHPWCKH-UHFFFAOYSA-N. The full InChI is InChI=1S/2C7H11N2.W/c2*1-8-6-4-3-5-7(6)9-2;/h2*4,8-9H,3H2,1-2H3;/q2*-1;+2.
What are the key properties of bis(1-N,2-N-dimethylcyclopenta-2,5-diene-1,2-diamine);tungsten(2+)?
bis(1-N,2-N-dimethylcyclopenta-2,5-diene-1,2-diamine);tungsten(2+) has a molecular weight of 430.20 g/mol, XLogP of 0.80, 4 rotatable bonds, 4 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for bis(1-N,2-N-dimethylcyclopenta-2,5-diene-1,2-diamine);tungsten(2+) is sourced from PubChem (CID 58399755), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).