cyclobutyl-(4,4-dimethyl-1,4-azasilinan-1-yl)methanone

C11H21NOSi — CID 90238953

IUPACcyclobutyl-(4,4-dimethyl-1,4-azasilinan-1-yl)methanone
SMILESC[Si]1(C)CCN(C(=O)C2CCC2)CC1
InChIInChI=1S/C11H21NOSi/c1-14(2)8-6-12(7-9-14)11(13)10-4-3-5-10/h10H,3-9H2,1-2H3
InChIKeyYBVWPXYGMSQNHC-UHFFFAOYSA-N
MW211.38 g/mol
LogP2.34
Rot. Bonds1

About cyclobutyl-(4,4-dimethyl-1,4-azasilinan-1-yl)methanone

cyclobutyl-(4,4-dimethyl-1,4-azasilinan-1-yl)methanone (PubChem CID 90238953) has the molecular formula C11H21NOSi and a molecular weight of 211.38 g/mol. Its IUPAC name is cyclobutyl-(4,4-dimethyl-1,4-azasilinan-1-yl)methanone.

Molecular Properties

Compound Namecyclobutyl-(4,4-dimethyl-1,4-azasilinan-1-yl)methanone
PubChem CID90238953
Molecular FormulaC11H21NOSi
Molecular Weight211.38 g/mol
Exact Mass211.14
IUPAC Namecyclobutyl-(4,4-dimethyl-1,4-azasilinan-1-yl)methanone
SMILESC[Si]1(C)CCN(C(=O)C2CCC2)CC1
InChIInChI=1S/C11H21NOSi/c1-14(2)8-6-12(7-9-14)11(13)10-4-3-5-10/h10H,3-9H2,1-2H3
InChIKeyYBVWPXYGMSQNHC-UHFFFAOYSA-N
XLogP2.34
TPSA20.31 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds1
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500211.38
LogP ≤ 52.34
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

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1-[4-(cyclobutanecarbonyl)-1,4-diazepan-1-yl]propan-1-one
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Frequently Asked Questions

What is the IUPAC name of cyclobutyl-(4,4-dimethyl-1,4-azasilinan-1-yl)methanone?
The IUPAC name of cyclobutyl-(4,4-dimethyl-1,4-azasilinan-1-yl)methanone (CID 90238953) is cyclobutyl-(4,4-dimethyl-1,4-azasilinan-1-yl)methanone.
What is the SMILES notation for cyclobutyl-(4,4-dimethyl-1,4-azasilinan-1-yl)methanone?
The canonical SMILES for cyclobutyl-(4,4-dimethyl-1,4-azasilinan-1-yl)methanone is C[Si]1(C)CCN(C(=O)C2CCC2)CC1.
What is the InChIKey of cyclobutyl-(4,4-dimethyl-1,4-azasilinan-1-yl)methanone?
The InChIKey is YBVWPXYGMSQNHC-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H21NOSi/c1-14(2)8-6-12(7-9-14)11(13)10-4-3-5-10/h10H,3-9H2,1-2H3.
What are the key properties of cyclobutyl-(4,4-dimethyl-1,4-azasilinan-1-yl)methanone?
cyclobutyl-(4,4-dimethyl-1,4-azasilinan-1-yl)methanone has a molecular weight of 211.38 g/mol, XLogP of 2.34, 1 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for cyclobutyl-(4,4-dimethyl-1,4-azasilinan-1-yl)methanone is sourced from PubChem (CID 90238953), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).