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

C15H26N2OSi — CID 86178368

IUPAC1-[1-[dimethyl(phenyl)silyl]propyl]-1,3,3-trimethylurea
SMILESCCC(N(C)C(=O)N(C)C)[Si](C)(C)c1ccccc1
InChIInChI=1S/C15H26N2OSi/c1-7-14(17(4)15(18)16(2)3)19(5,6)13-11-9-8-10-12-13/h8-12,14H,7H2,1-6H3
InChIKeyOJTZTOHZEKALBQ-UHFFFAOYSA-N
MW278.47 g/mol
LogP2.53
Rot. Bonds4

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

1-[1-[dimethyl(phenyl)silyl]propyl]-1,3,3-trimethylurea (PubChem CID 86178368) has the molecular formula C15H26N2OSi and a molecular weight of 278.47 g/mol. Its IUPAC name is 1-[1-[dimethyl(phenyl)silyl]propyl]-1,3,3-trimethylurea.

Molecular Properties

Compound Name1-[1-[dimethyl(phenyl)silyl]propyl]-1,3,3-trimethylurea
PubChem CID86178368
Molecular FormulaC15H26N2OSi
Molecular Weight278.47 g/mol
Exact Mass278.18
IUPAC Name1-[1-[dimethyl(phenyl)silyl]propyl]-1,3,3-trimethylurea
SMILESCCC(N(C)C(=O)N(C)C)[Si](C)(C)c1ccccc1
InChIInChI=1S/C15H26N2OSi/c1-7-14(17(4)15(18)16(2)3)19(5,6)13-11-9-8-10-12-13/h8-12,14H,7H2,1-6H3
InChIKeyOJTZTOHZEKALBQ-UHFFFAOYSA-N
XLogP2.53
TPSA23.55 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds4
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500278.47
LogP ≤ 52.53
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

Computed Properties (RDKit)

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

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Related Compounds

3-[1-[Dimethyl(phenyl)silyl]propyl]-1,1-dimethylurea
CID 86178367
1-[dimethyl(phenyl)silyl]-N,N-dimethylformamide
CID 102383726
bis(N-methylacetamido)methylphenylsilane
CID 129698383
1-[(Z)-but-2-en-2-yl]-1-[1-[dimethyl(phenyl)silyl]propyl]-3,3-dimethylurea
CID 134900985
Ethylphenylsilylurea
CID 177796136
CID 57071549
CID 57071549
CID 57130973
CID 57130973
CID 67403419
CID 67403419
Benzene;1,3-dimethyl-1,3-diazinan-2-one
CID 70209375
1-Butyl-3-[3-[dimethyl-(4-trimethylsilylphenyl)silyl]propyl]-5-methyl-1,3,5-triazinane-2,4,6-trione
CID 71078798
Benzene;1-tert-butyl-1,3,3-trimethylurea;ethane
CID 91227131
1-N,1-N,1-N',1-N'-tetramethyl-4-phenylsilylbutane-1,1-diamine
CID 123198597

Frequently Asked Questions

What is the IUPAC name of 1-[1-[dimethyl(phenyl)silyl]propyl]-1,3,3-trimethylurea?
The IUPAC name of 1-[1-[dimethyl(phenyl)silyl]propyl]-1,3,3-trimethylurea (CID 86178368) is 1-[1-[dimethyl(phenyl)silyl]propyl]-1,3,3-trimethylurea.
What is the SMILES notation for 1-[1-[dimethyl(phenyl)silyl]propyl]-1,3,3-trimethylurea?
The canonical SMILES for 1-[1-[dimethyl(phenyl)silyl]propyl]-1,3,3-trimethylurea is CCC(N(C)C(=O)N(C)C)[Si](C)(C)c1ccccc1.
What is the InChIKey of 1-[1-[dimethyl(phenyl)silyl]propyl]-1,3,3-trimethylurea?
The InChIKey is OJTZTOHZEKALBQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H26N2OSi/c1-7-14(17(4)15(18)16(2)3)19(5,6)13-11-9-8-10-12-13/h8-12,14H,7H2,1-6H3.
What are the key properties of 1-[1-[dimethyl(phenyl)silyl]propyl]-1,3,3-trimethylurea?
1-[1-[dimethyl(phenyl)silyl]propyl]-1,3,3-trimethylurea has a molecular weight of 278.47 g/mol, XLogP of 2.53, 4 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 1-[1-[dimethyl(phenyl)silyl]propyl]-1,3,3-trimethylurea is sourced from PubChem (CID 86178368), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).