(E)-N,N-dimethyl-3-phenylprop-2-eneselenoamide

C11H13NSe — CID 11096649

IUPAC(E)-N,N-dimethyl-3-phenylprop-2-eneselenoamide
SMILESCN(C)C(=[Se])/C=C/c1ccccc1
InChIInChI=1S/C11H13NSe/c1-12(2)11(13)9-8-10-6-4-3-5-7-10/h3-9H,1-2H3/b9-8+
InChIKeyZRTVNSQCVZXLAZ-CMDGGOBGSA-N
MW238.19 g/mol
LogP1.56
Rot. Bonds3

About (E)-N,N-dimethyl-3-phenylprop-2-eneselenoamide

(E)-N,N-dimethyl-3-phenylprop-2-eneselenoamide (PubChem CID 11096649) has the molecular formula C11H13NSe and a molecular weight of 238.19 g/mol. Its IUPAC name is (E)-N,N-dimethyl-3-phenylprop-2-eneselenoamide.

Molecular Properties

Compound Name(E)-N,N-dimethyl-3-phenylprop-2-eneselenoamide
PubChem CID11096649
Molecular FormulaC11H13NSe
Molecular Weight238.19 g/mol
Exact Mass239.02
IUPAC Name(E)-N,N-dimethyl-3-phenylprop-2-eneselenoamide
SMILESCN(C)C(=[Se])/C=C/c1ccccc1
InChIInChI=1S/C11H13NSe/c1-12(2)11(13)9-8-10-6-4-3-5-7-10/h3-9H,1-2H3/b9-8+
InChIKeyZRTVNSQCVZXLAZ-CMDGGOBGSA-N
XLogP1.56
TPSA3.24 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds3
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500238.19
LogP ≤ 51.56
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

Computed Properties (RDKit)

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

Analyze (E)-N,N-dimethyl-3-phenylprop-2-eneselenoamide with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

N,N-dimethylmethanamine;stilbene
CID 174368184
CID 175667798
CID 175667798
ethane;methanamine;(E)-3-phenylprop-2-enoic acid
CID 142207731
dimethylamino (E)-3-phenylprop-2-enoate
CID 174325231
[(1Z)-3-methoxybuta-1,3-dienyl]benzene
CID 24972289
[(3E)-3-tert-butylpenta-1,3-dienyl]benzene
CID 144969758
(E)-N-[amino(dimethylamino)methylidene]-3-phenylprop-2-enamide
CID 58870295
(Z)-3-phenylprop-2-enoic acid
CID 5372954
(3,4-difluoro-6-phenylhexa-1,3,5-trienyl)benzene
CID 53441080
(1E,4E)-1,5-diphenylpenta-1,4-dien-3-one
CID 157206787
(E)-3-(dimethylamino)-N,N-diphenylprop-2-eneselenoamide
CID 11267471
(4E)-1,5-diphenylpenta-1,4-dien-3-one;propan-2-one
CID 158678637

Frequently Asked Questions

What is the IUPAC name of (E)-N,N-dimethyl-3-phenylprop-2-eneselenoamide?
The IUPAC name of (E)-N,N-dimethyl-3-phenylprop-2-eneselenoamide (CID 11096649) is (E)-N,N-dimethyl-3-phenylprop-2-eneselenoamide.
What is the SMILES notation for (E)-N,N-dimethyl-3-phenylprop-2-eneselenoamide?
The canonical SMILES for (E)-N,N-dimethyl-3-phenylprop-2-eneselenoamide is CN(C)C(=[Se])/C=C/c1ccccc1.
What is the InChIKey of (E)-N,N-dimethyl-3-phenylprop-2-eneselenoamide?
The InChIKey is ZRTVNSQCVZXLAZ-CMDGGOBGSA-N. The full InChI is InChI=1S/C11H13NSe/c1-12(2)11(13)9-8-10-6-4-3-5-7-10/h3-9H,1-2H3/b9-8+.
What are the key properties of (E)-N,N-dimethyl-3-phenylprop-2-eneselenoamide?
(E)-N,N-dimethyl-3-phenylprop-2-eneselenoamide has a molecular weight of 238.19 g/mol, XLogP of 1.56, 3 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for (E)-N,N-dimethyl-3-phenylprop-2-eneselenoamide is sourced from PubChem (CID 11096649), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).