3-[1-[dimethyl(phenyl)silyl]propyl]-1,1-dimethylurea

C14H24N2OSi — CID 86178367

IUPAC3-[1-[dimethyl(phenyl)silyl]propyl]-1,1-dimethylurea
SMILESCCC(NC(=O)N(C)C)[Si](C)(C)c1ccccc1
InChIInChI=1S/C14H24N2OSi/c1-6-13(15-14(17)16(2)3)18(4,5)12-10-8-7-9-11-12/h7-11,13H,6H2,1-5H3,(H,15,17)
InChIKeyJSWYPPNWKMFRHL-UHFFFAOYSA-N
MW264.44 g/mol
LogP2.19
Rot. Bonds4

About 3-[1-[dimethyl(phenyl)silyl]propyl]-1,1-dimethylurea

3-[1-[dimethyl(phenyl)silyl]propyl]-1,1-dimethylurea (PubChem CID 86178367) has the molecular formula C14H24N2OSi and a molecular weight of 264.44 g/mol. Its IUPAC name is 3-[1-[dimethyl(phenyl)silyl]propyl]-1,1-dimethylurea.

Molecular Properties

Compound Name3-[1-[dimethyl(phenyl)silyl]propyl]-1,1-dimethylurea
PubChem CID86178367
Molecular FormulaC14H24N2OSi
Molecular Weight264.44 g/mol
Exact Mass264.17
IUPAC Name3-[1-[dimethyl(phenyl)silyl]propyl]-1,1-dimethylurea
SMILESCCC(NC(=O)N(C)C)[Si](C)(C)c1ccccc1
InChIInChI=1S/C14H24N2OSi/c1-6-13(15-14(17)16(2)3)18(4,5)12-10-8-7-9-11-12/h7-11,13H,6H2,1-5H3,(H,15,17)
InChIKeyJSWYPPNWKMFRHL-UHFFFAOYSA-N
XLogP2.19
TPSA32.34 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds4
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500264.44
LogP ≤ 52.19
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

Computed Properties (RDKit)

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

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Related Compounds

N-[1-[dimethyl(phenyl)silyl]propyl]acetamide
CID 11075395
1-[1-[Dimethyl(phenyl)silyl]propyl]-1,3,3-trimethylurea
CID 86178368
1-[(Z)-but-2-en-2-yl]-1-[1-[dimethyl(phenyl)silyl]propyl]-3,3-dimethylurea
CID 134900985
Ethylphenylsilylurea
CID 177796136
N-[[dimethyl(phenyl)silyl]methyl]acetamide
CID 262877
Benzene;propan-2-ylurea
CID 20243226
Benzene;1,1-dimethyl-3-propan-2-ylurea
CID 20363267
Benzene;1-methyl-3-propan-2-ylurea
CID 20363277
4-[[dimethyl(phenyl)silyl]methyl]-N-ethylpiperazine-1-carboxamide
CID 20728655
CID 21328209
CID 21328209
1,3-Dimethyl-1-[methyl-[methyl(methylcarbamoyl)amino]-phenylsilyl]urea
CID 54086287
1-[dimethyl(phenyl)silyl]-N'-ethylmethanediamine
CID 68625676

Frequently Asked Questions

What is the IUPAC name of 3-[1-[dimethyl(phenyl)silyl]propyl]-1,1-dimethylurea?
The IUPAC name of 3-[1-[dimethyl(phenyl)silyl]propyl]-1,1-dimethylurea (CID 86178367) is 3-[1-[dimethyl(phenyl)silyl]propyl]-1,1-dimethylurea.
What is the SMILES notation for 3-[1-[dimethyl(phenyl)silyl]propyl]-1,1-dimethylurea?
The canonical SMILES for 3-[1-[dimethyl(phenyl)silyl]propyl]-1,1-dimethylurea is CCC(NC(=O)N(C)C)[Si](C)(C)c1ccccc1.
What is the InChIKey of 3-[1-[dimethyl(phenyl)silyl]propyl]-1,1-dimethylurea?
The InChIKey is JSWYPPNWKMFRHL-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H24N2OSi/c1-6-13(15-14(17)16(2)3)18(4,5)12-10-8-7-9-11-12/h7-11,13H,6H2,1-5H3,(H,15,17).
What are the key properties of 3-[1-[dimethyl(phenyl)silyl]propyl]-1,1-dimethylurea?
3-[1-[dimethyl(phenyl)silyl]propyl]-1,1-dimethylurea has a molecular weight of 264.44 g/mol, XLogP of 2.19, 4 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 3-[1-[dimethyl(phenyl)silyl]propyl]-1,1-dimethylurea is sourced from PubChem (CID 86178367), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).