1,3-dimethyl-1-phenyltellanylurea

C9H12N2OTe — CID 87932984

IUPAC1,3-dimethyl-1-phenyltellanylurea
SMILESCNC(=O)N(C)[Te]c1ccccc1
InChIInChI=1S/C9H12N2OTe/c1-10-9(12)11(2)13-8-6-4-3-5-7-8/h3-7H,1-2H3,(H,10,12)
InChIKeyKAKPXNQZPRVFBJ-UHFFFAOYSA-N
MW291.81 g/mol
LogP0.20
Rot. Bonds2

About 1,3-dimethyl-1-phenyltellanylurea

1,3-dimethyl-1-phenyltellanylurea (PubChem CID 87932984) has the molecular formula C9H12N2OTe and a molecular weight of 291.81 g/mol. Its IUPAC name is 1,3-dimethyl-1-phenyltellanylurea.

Molecular Properties

Compound Name1,3-dimethyl-1-phenyltellanylurea
PubChem CID87932984
Molecular FormulaC9H12N2OTe
Molecular Weight291.81 g/mol
Exact Mass294.00
IUPAC Name1,3-dimethyl-1-phenyltellanylurea
SMILESCNC(=O)N(C)[Te]c1ccccc1
InChIInChI=1S/C9H12N2OTe/c1-10-9(12)11(2)13-8-6-4-3-5-7-8/h3-7H,1-2H3,(H,10,12)
InChIKeyKAKPXNQZPRVFBJ-UHFFFAOYSA-N
XLogP0.20
TPSA32.34 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds2
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500291.81
LogP ≤ 50.20
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

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 1,3-dimethyl-1-phenyltellanylurea?
The IUPAC name of 1,3-dimethyl-1-phenyltellanylurea (CID 87932984) is 1,3-dimethyl-1-phenyltellanylurea.
What is the SMILES notation for 1,3-dimethyl-1-phenyltellanylurea?
The canonical SMILES for 1,3-dimethyl-1-phenyltellanylurea is CNC(=O)N(C)[Te]c1ccccc1.
What is the InChIKey of 1,3-dimethyl-1-phenyltellanylurea?
The InChIKey is KAKPXNQZPRVFBJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H12N2OTe/c1-10-9(12)11(2)13-8-6-4-3-5-7-8/h3-7H,1-2H3,(H,10,12).
What are the key properties of 1,3-dimethyl-1-phenyltellanylurea?
1,3-dimethyl-1-phenyltellanylurea has a molecular weight of 291.81 g/mol, XLogP of 0.20, 2 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 1,3-dimethyl-1-phenyltellanylurea is sourced from PubChem (CID 87932984), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).