N-[cyclopenta-2,4-dien-1-yl(dimethyl)silyl]prop-2-en-1-amine

C10H17NSi — CID 121235804

IUPACN-[cyclopenta-2,4-dien-1-yl(dimethyl)silyl]prop-2-en-1-amine
SMILESC=CCN[Si](C)(C)C1C=CC=C1
InChIInChI=1S/C10H17NSi/c1-4-9-11-12(2,3)10-7-5-6-8-10/h4-8,10-11H,1,9H2,2-3H3
InChIKeyHDLAEDLUXSWNIR-UHFFFAOYSA-N
MW179.34 g/mol
LogP2.46
Rot. Bonds4

About N-[cyclopenta-2,4-dien-1-yl(dimethyl)silyl]prop-2-en-1-amine

N-[cyclopenta-2,4-dien-1-yl(dimethyl)silyl]prop-2-en-1-amine (PubChem CID 121235804) has the molecular formula C10H17NSi and a molecular weight of 179.34 g/mol. Its IUPAC name is N-[cyclopenta-2,4-dien-1-yl(dimethyl)silyl]prop-2-en-1-amine.

Molecular Properties

Compound NameN-[cyclopenta-2,4-dien-1-yl(dimethyl)silyl]prop-2-en-1-amine
PubChem CID121235804
Molecular FormulaC10H17NSi
Molecular Weight179.34 g/mol
Exact Mass179.11
IUPAC NameN-[cyclopenta-2,4-dien-1-yl(dimethyl)silyl]prop-2-en-1-amine
SMILESC=CCN[Si](C)(C)C1C=CC=C1
InChIInChI=1S/C10H17NSi/c1-4-9-11-12(2,3)10-7-5-6-8-10/h4-8,10-11H,1,9H2,2-3H3
InChIKeyHDLAEDLUXSWNIR-UHFFFAOYSA-N
XLogP2.46
TPSA12.03 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds4
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500179.34
LogP ≤ 52.46
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

Computed Properties (RDKit)

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

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Frequently Asked Questions

What is the IUPAC name of N-[cyclopenta-2,4-dien-1-yl(dimethyl)silyl]prop-2-en-1-amine?
The IUPAC name of N-[cyclopenta-2,4-dien-1-yl(dimethyl)silyl]prop-2-en-1-amine (CID 121235804) is N-[cyclopenta-2,4-dien-1-yl(dimethyl)silyl]prop-2-en-1-amine.
What is the SMILES notation for N-[cyclopenta-2,4-dien-1-yl(dimethyl)silyl]prop-2-en-1-amine?
The canonical SMILES for N-[cyclopenta-2,4-dien-1-yl(dimethyl)silyl]prop-2-en-1-amine is C=CCN[Si](C)(C)C1C=CC=C1.
What is the InChIKey of N-[cyclopenta-2,4-dien-1-yl(dimethyl)silyl]prop-2-en-1-amine?
The InChIKey is HDLAEDLUXSWNIR-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H17NSi/c1-4-9-11-12(2,3)10-7-5-6-8-10/h4-8,10-11H,1,9H2,2-3H3.
What are the key properties of N-[cyclopenta-2,4-dien-1-yl(dimethyl)silyl]prop-2-en-1-amine?
N-[cyclopenta-2,4-dien-1-yl(dimethyl)silyl]prop-2-en-1-amine has a molecular weight of 179.34 g/mol, XLogP of 2.46, 4 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for N-[cyclopenta-2,4-dien-1-yl(dimethyl)silyl]prop-2-en-1-amine is sourced from PubChem (CID 121235804), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).