N-[dimethyl-(2,3,4,5-tetramethylcyclopenta-1,3-dien-1-yl)silyl]butan-1-amine

C15H29NSi — CID 23283933

IUPACN-[dimethyl-(2,3,4,5-tetramethylcyclopenta-1,3-dien-1-yl)silyl]butan-1-amine
SMILESCCCCN[Si](C)(C)C1=C(C)C(C)=C(C)C1C
InChIInChI=1S/C15H29NSi/c1-8-9-10-16-17(6,7)15-13(4)11(2)12(3)14(15)5/h13,16H,8-10H2,1-7H3
InChIKeyOQUVECXIZIVTIB-UHFFFAOYSA-N
MW251.49 g/mol
LogP4.42
Rot. Bonds5

About N-[dimethyl-(2,3,4,5-tetramethylcyclopenta-1,3-dien-1-yl)silyl]butan-1-amine

N-[dimethyl-(2,3,4,5-tetramethylcyclopenta-1,3-dien-1-yl)silyl]butan-1-amine (PubChem CID 23283933) has the molecular formula C15H29NSi and a molecular weight of 251.49 g/mol. Its IUPAC name is N-[dimethyl-(2,3,4,5-tetramethylcyclopenta-1,3-dien-1-yl)silyl]butan-1-amine.

Molecular Properties

Compound NameN-[dimethyl-(2,3,4,5-tetramethylcyclopenta-1,3-dien-1-yl)silyl]butan-1-amine
PubChem CID23283933
Molecular FormulaC15H29NSi
Molecular Weight251.49 g/mol
Exact Mass251.21
IUPAC NameN-[dimethyl-(2,3,4,5-tetramethylcyclopenta-1,3-dien-1-yl)silyl]butan-1-amine
SMILESCCCCN[Si](C)(C)C1=C(C)C(C)=C(C)C1C
InChIInChI=1S/C15H29NSi/c1-8-9-10-16-17(6,7)15-13(4)11(2)12(3)14(15)5/h13,16H,8-10H2,1-7H3
InChIKeyOQUVECXIZIVTIB-UHFFFAOYSA-N
XLogP4.42
TPSA12.03 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds5
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500251.49
LogP ≤ 54.42
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

Computed Properties (RDKit)

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

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Frequently Asked Questions

What is the IUPAC name of N-[dimethyl-(2,3,4,5-tetramethylcyclopenta-1,3-dien-1-yl)silyl]butan-1-amine?
The IUPAC name of N-[dimethyl-(2,3,4,5-tetramethylcyclopenta-1,3-dien-1-yl)silyl]butan-1-amine (CID 23283933) is N-[dimethyl-(2,3,4,5-tetramethylcyclopenta-1,3-dien-1-yl)silyl]butan-1-amine.
What is the SMILES notation for N-[dimethyl-(2,3,4,5-tetramethylcyclopenta-1,3-dien-1-yl)silyl]butan-1-amine?
The canonical SMILES for N-[dimethyl-(2,3,4,5-tetramethylcyclopenta-1,3-dien-1-yl)silyl]butan-1-amine is CCCCN[Si](C)(C)C1=C(C)C(C)=C(C)C1C.
What is the InChIKey of N-[dimethyl-(2,3,4,5-tetramethylcyclopenta-1,3-dien-1-yl)silyl]butan-1-amine?
The InChIKey is OQUVECXIZIVTIB-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H29NSi/c1-8-9-10-16-17(6,7)15-13(4)11(2)12(3)14(15)5/h13,16H,8-10H2,1-7H3.
What are the key properties of N-[dimethyl-(2,3,4,5-tetramethylcyclopenta-1,3-dien-1-yl)silyl]butan-1-amine?
N-[dimethyl-(2,3,4,5-tetramethylcyclopenta-1,3-dien-1-yl)silyl]butan-1-amine has a molecular weight of 251.49 g/mol, XLogP of 4.42, 5 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for N-[dimethyl-(2,3,4,5-tetramethylcyclopenta-1,3-dien-1-yl)silyl]butan-1-amine is sourced from PubChem (CID 23283933), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).