N-[cyclopenta-1,4-dien-1-yl(dimethyl)silyl]butan-1-amine

C11H21NSi — CID 11106261

IUPACN-[cyclopenta-1,4-dien-1-yl(dimethyl)silyl]butan-1-amine
SMILESCCCCN[Si](C)(C)C1=CCC=C1
InChIInChI=1S/C11H21NSi/c1-4-5-10-12-13(2,3)11-8-6-7-9-11/h6,8-9,12H,4-5,7,10H2,1-3H3
InChIKeyRNEHQJHOCAGNCF-UHFFFAOYSA-N
MW195.38 g/mol
LogP3.01
Rot. Bonds5

About N-[cyclopenta-1,4-dien-1-yl(dimethyl)silyl]butan-1-amine

N-[cyclopenta-1,4-dien-1-yl(dimethyl)silyl]butan-1-amine (PubChem CID 11106261) has the molecular formula C11H21NSi and a molecular weight of 195.38 g/mol. Its IUPAC name is N-[cyclopenta-1,4-dien-1-yl(dimethyl)silyl]butan-1-amine.

Molecular Properties

Compound NameN-[cyclopenta-1,4-dien-1-yl(dimethyl)silyl]butan-1-amine
PubChem CID11106261
Molecular FormulaC11H21NSi
Molecular Weight195.38 g/mol
Exact Mass195.14
IUPAC NameN-[cyclopenta-1,4-dien-1-yl(dimethyl)silyl]butan-1-amine
SMILESCCCCN[Si](C)(C)C1=CCC=C1
InChIInChI=1S/C11H21NSi/c1-4-5-10-12-13(2,3)11-8-6-7-9-11/h6,8-9,12H,4-5,7,10H2,1-3H3
InChIKeyRNEHQJHOCAGNCF-UHFFFAOYSA-N
XLogP3.01
TPSA12.03 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds5
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500195.38
LogP ≤ 53.01
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'}

Analyze N-[cyclopenta-1,4-dien-1-yl(dimethyl)silyl]butan-1-amine with MolForge

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Launch Full Analysis

Related Compounds

6-Trimethylsilylhex-4-en-1-amine
CID 73182581
N-[cyclopenta-2,4-dien-1-yl(dimethyl)silyl]butan-1-amine
CID 11298514
N-[cyclopenta-1,3-dien-1-ylmethyl(dimethyl)silyl]butan-1-amine
CID 17763668
N-[cyclopenta-2,4-dien-1-yl(dimethyl)silyl]methanamine
CID 20829076
N-[cyclopenta-1,3-dien-1-yl(dimethyl)silyl]cyclohexanamine
CID 23286625
N-[dimethyl-(2-methylcyclopenta-1,3-dien-1-yl)silyl]butan-1-amine
CID 69977947
N-[cyclopenta-1,4-dien-1-yl(dimethyl)silyl]propan-2-amine;titanium;dihydrochloride
CID 87074130
N-[cyclopenta-1,4-dien-1-yl(dimethyl)silyl]propan-2-amine;titanium(3+);dichloride
CID 87995931
N-[cyclopenta-2,4-dien-1-ylmethyl(dimethyl)silyl]propan-1-amine
CID 141660313
N-[cyclopenta-2,4-dien-1-ylmethyl(dimethyl)silyl]methanamine
CID 141660329
N-[cyclopenta-2,4-dien-1-ylmethyl(dimethyl)silyl]propan-2-amine
CID 141721604
3-Trimethylsilylhexa-3,5-dien-1-amine
CID 153903921

Frequently Asked Questions

What is the IUPAC name of N-[cyclopenta-1,4-dien-1-yl(dimethyl)silyl]butan-1-amine?
The IUPAC name of N-[cyclopenta-1,4-dien-1-yl(dimethyl)silyl]butan-1-amine (CID 11106261) is N-[cyclopenta-1,4-dien-1-yl(dimethyl)silyl]butan-1-amine.
What is the SMILES notation for N-[cyclopenta-1,4-dien-1-yl(dimethyl)silyl]butan-1-amine?
The canonical SMILES for N-[cyclopenta-1,4-dien-1-yl(dimethyl)silyl]butan-1-amine is CCCCN[Si](C)(C)C1=CCC=C1.
What is the InChIKey of N-[cyclopenta-1,4-dien-1-yl(dimethyl)silyl]butan-1-amine?
The InChIKey is RNEHQJHOCAGNCF-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H21NSi/c1-4-5-10-12-13(2,3)11-8-6-7-9-11/h6,8-9,12H,4-5,7,10H2,1-3H3.
What are the key properties of N-[cyclopenta-1,4-dien-1-yl(dimethyl)silyl]butan-1-amine?
N-[cyclopenta-1,4-dien-1-yl(dimethyl)silyl]butan-1-amine has a molecular weight of 195.38 g/mol, XLogP of 3.01, 5 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for N-[cyclopenta-1,4-dien-1-yl(dimethyl)silyl]butan-1-amine is sourced from PubChem (CID 11106261), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).