(4-methylidene-2-propan-2-yl-3H-pyrrol-5-ylidene)tungsten

C8H11NW — CID 59616728

IUPAC(4-methylidene-2-propan-2-yl-3H-pyrrol-5-ylidene)tungsten
SMILESC=C1CC(C(C)C)=NC1=[W]
InChIInChI=1S/C8H11N.W/c1-6(2)8-4-7(3)5-9-8;/h6H,3-4H2,1-2H3;
InChIKeyUNPQCRHAKUZURF-UHFFFAOYSA-N
MW305.02 g/mol
LogP1.72
Rot. Bonds1

About (4-methylidene-2-propan-2-yl-3H-pyrrol-5-ylidene)tungsten

(4-methylidene-2-propan-2-yl-3H-pyrrol-5-ylidene)tungsten (PubChem CID 59616728) has the molecular formula C8H11NW and a molecular weight of 305.02 g/mol. Its IUPAC name is (4-methylidene-2-propan-2-yl-3H-pyrrol-5-ylidene)tungsten.

Molecular Properties

Compound Name(4-methylidene-2-propan-2-yl-3H-pyrrol-5-ylidene)tungsten
PubChem CID59616728
Molecular FormulaC8H11NW
Molecular Weight305.02 g/mol
Exact Mass305.04
IUPAC Name(4-methylidene-2-propan-2-yl-3H-pyrrol-5-ylidene)tungsten
SMILESC=C1CC(C(C)C)=NC1=[W]
InChIInChI=1S/C8H11N.W/c1-6(2)8-4-7(3)5-9-8;/h6H,3-4H2,1-2H3;
InChIKeyUNPQCRHAKUZURF-UHFFFAOYSA-N
XLogP1.72
TPSA12.36 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds1
Heavy Atoms10
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500305.02
LogP ≤ 51.72
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

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Frequently Asked Questions

What is the IUPAC name of (4-methylidene-2-propan-2-yl-3H-pyrrol-5-ylidene)tungsten?
The IUPAC name of (4-methylidene-2-propan-2-yl-3H-pyrrol-5-ylidene)tungsten (CID 59616728) is (4-methylidene-2-propan-2-yl-3H-pyrrol-5-ylidene)tungsten.
What is the SMILES notation for (4-methylidene-2-propan-2-yl-3H-pyrrol-5-ylidene)tungsten?
The canonical SMILES for (4-methylidene-2-propan-2-yl-3H-pyrrol-5-ylidene)tungsten is C=C1CC(C(C)C)=NC1=[W].
What is the InChIKey of (4-methylidene-2-propan-2-yl-3H-pyrrol-5-ylidene)tungsten?
The InChIKey is UNPQCRHAKUZURF-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H11N.W/c1-6(2)8-4-7(3)5-9-8;/h6H,3-4H2,1-2H3;.
What are the key properties of (4-methylidene-2-propan-2-yl-3H-pyrrol-5-ylidene)tungsten?
(4-methylidene-2-propan-2-yl-3H-pyrrol-5-ylidene)tungsten has a molecular weight of 305.02 g/mol, XLogP of 1.72, 1 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for (4-methylidene-2-propan-2-yl-3H-pyrrol-5-ylidene)tungsten is sourced from PubChem (CID 59616728), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).