N,N-dimethyl-4-phenyl-1,3-selenazol-2-amine

C11H12N2Se — CID 15437866

IUPACN,N-dimethyl-4-phenyl-1,3-selenazol-2-amine
SMILESCN(C)c1nc(-c2ccccc2)c[se]1
InChIInChI=1S/C11H12N2Se/c1-13(2)11-12-10(8-14-11)9-6-4-3-5-7-9/h3-8H,1-2H3
InChIKeyFAWACSAMXFCPIU-UHFFFAOYSA-N
MW251.19 g/mol
LogP1.87
Rot. Bonds2

About N,N-dimethyl-4-phenyl-1,3-selenazol-2-amine

N,N-dimethyl-4-phenyl-1,3-selenazol-2-amine (PubChem CID 15437866) has the molecular formula C11H12N2Se and a molecular weight of 251.19 g/mol. Its IUPAC name is N,N-dimethyl-4-phenyl-1,3-selenazol-2-amine.

Molecular Properties

Compound NameN,N-dimethyl-4-phenyl-1,3-selenazol-2-amine
PubChem CID15437866
Molecular FormulaC11H12N2Se
Molecular Weight251.19 g/mol
Exact Mass252.02
IUPAC NameN,N-dimethyl-4-phenyl-1,3-selenazol-2-amine
SMILESCN(C)c1nc(-c2ccccc2)c[se]1
InChIInChI=1S/C11H12N2Se/c1-13(2)11-12-10(8-14-11)9-6-4-3-5-7-9/h3-8H,1-2H3
InChIKeyFAWACSAMXFCPIU-UHFFFAOYSA-N
XLogP1.87
TPSA16.13 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms14
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500251.19
LogP ≤ 51.87
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 N,N-dimethyl-4-phenyl-1,3-selenazol-2-amine?
The IUPAC name of N,N-dimethyl-4-phenyl-1,3-selenazol-2-amine (CID 15437866) is N,N-dimethyl-4-phenyl-1,3-selenazol-2-amine.
What is the SMILES notation for N,N-dimethyl-4-phenyl-1,3-selenazol-2-amine?
The canonical SMILES for N,N-dimethyl-4-phenyl-1,3-selenazol-2-amine is CN(C)c1nc(-c2ccccc2)c[se]1.
What is the InChIKey of N,N-dimethyl-4-phenyl-1,3-selenazol-2-amine?
The InChIKey is FAWACSAMXFCPIU-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H12N2Se/c1-13(2)11-12-10(8-14-11)9-6-4-3-5-7-9/h3-8H,1-2H3.
What are the key properties of N,N-dimethyl-4-phenyl-1,3-selenazol-2-amine?
N,N-dimethyl-4-phenyl-1,3-selenazol-2-amine has a molecular weight of 251.19 g/mol, XLogP of 1.87, 2 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N,N-dimethyl-4-phenyl-1,3-selenazol-2-amine is sourced from PubChem (CID 15437866), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).