1,1,3,3-tetramethylselenourea

C5H12N2Se — CID 10976069

IUPAC1,1,3,3-tetramethylselenourea
SMILESCN(C)C(=[Se])N(C)C
InChIInChI=1S/C5H12N2Se/c1-6(2)5(8)7(3)4/h1-4H3
InChIKeyWUKNXMYCJYGLGA-UHFFFAOYSA-N
MW179.12 g/mol
LogP-0.63
Rot. Bonds2

About 1,1,3,3-tetramethylselenourea

1,1,3,3-tetramethylselenourea (PubChem CID 10976069) has the molecular formula C5H12N2Se and a molecular weight of 179.12 g/mol. Its IUPAC name is 1,1,3,3-tetramethylselenourea.

Molecular Properties

Compound Name1,1,3,3-tetramethylselenourea
PubChem CID10976069
Molecular FormulaC5H12N2Se
Molecular Weight179.12 g/mol
Exact Mass180.02
IUPAC Name1,1,3,3-tetramethylselenourea
SMILESCN(C)C(=[Se])N(C)C
InChIInChI=1S/C5H12N2Se/c1-6(2)5(8)7(3)4/h1-4H3
InChIKeyWUKNXMYCJYGLGA-UHFFFAOYSA-N
XLogP-0.63
TPSA6.48 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms8
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500179.12
LogP ≤ 5-0.63
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

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

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Frequently Asked Questions

What is the IUPAC name of 1,1,3,3-tetramethylselenourea?
The IUPAC name of 1,1,3,3-tetramethylselenourea (CID 10976069) is 1,1,3,3-tetramethylselenourea.
What is the SMILES notation for 1,1,3,3-tetramethylselenourea?
The canonical SMILES for 1,1,3,3-tetramethylselenourea is CN(C)C(=[Se])N(C)C.
What is the InChIKey of 1,1,3,3-tetramethylselenourea?
The InChIKey is WUKNXMYCJYGLGA-UHFFFAOYSA-N. The full InChI is InChI=1S/C5H12N2Se/c1-6(2)5(8)7(3)4/h1-4H3.
What are the key properties of 1,1,3,3-tetramethylselenourea?
1,1,3,3-tetramethylselenourea has a molecular weight of 179.12 g/mol, XLogP of -0.63, 2 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 1,1,3,3-tetramethylselenourea is sourced from PubChem (CID 10976069), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).