N-[chloro(3,3-dimethylbutan-2-yl)silyl]methanamine

C7H18ClNSi — CID 173059570

IUPACN-[chloro(3,3-dimethylbutan-2-yl)silyl]methanamine
SMILESCN[SiH](Cl)C(C)C(C)(C)C
InChIInChI=1S/C7H18ClNSi/c1-6(7(2,3)4)10(8)9-5/h6,9-10H,1-5H3
InChIKeyGMGPHOXLLSWDED-UHFFFAOYSA-N
MW179.77 g/mol
LogP2.10
Rot. Bonds2

About N-[chloro(3,3-dimethylbutan-2-yl)silyl]methanamine

N-[chloro(3,3-dimethylbutan-2-yl)silyl]methanamine (PubChem CID 173059570) has the molecular formula C7H18ClNSi and a molecular weight of 179.77 g/mol. Its IUPAC name is N-[chloro(3,3-dimethylbutan-2-yl)silyl]methanamine.

Molecular Properties

Compound NameN-[chloro(3,3-dimethylbutan-2-yl)silyl]methanamine
PubChem CID173059570
Molecular FormulaC7H18ClNSi
Molecular Weight179.77 g/mol
Exact Mass179.09
IUPAC NameN-[chloro(3,3-dimethylbutan-2-yl)silyl]methanamine
SMILESCN[SiH](Cl)C(C)C(C)(C)C
InChIInChI=1S/C7H18ClNSi/c1-6(7(2,3)4)10(8)9-5/h6,9-10H,1-5H3
InChIKeyGMGPHOXLLSWDED-UHFFFAOYSA-N
XLogP2.10
TPSA12.03 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds2
Heavy Atoms10
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500179.77
LogP ≤ 52.10
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

Computed Properties (RDKit)

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

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Frequently Asked Questions

What is the IUPAC name of N-[chloro(3,3-dimethylbutan-2-yl)silyl]methanamine?
The IUPAC name of N-[chloro(3,3-dimethylbutan-2-yl)silyl]methanamine (CID 173059570) is N-[chloro(3,3-dimethylbutan-2-yl)silyl]methanamine.
What is the SMILES notation for N-[chloro(3,3-dimethylbutan-2-yl)silyl]methanamine?
The canonical SMILES for N-[chloro(3,3-dimethylbutan-2-yl)silyl]methanamine is CN[SiH](Cl)C(C)C(C)(C)C.
What is the InChIKey of N-[chloro(3,3-dimethylbutan-2-yl)silyl]methanamine?
The InChIKey is GMGPHOXLLSWDED-UHFFFAOYSA-N. The full InChI is InChI=1S/C7H18ClNSi/c1-6(7(2,3)4)10(8)9-5/h6,9-10H,1-5H3.
What are the key properties of N-[chloro(3,3-dimethylbutan-2-yl)silyl]methanamine?
N-[chloro(3,3-dimethylbutan-2-yl)silyl]methanamine has a molecular weight of 179.77 g/mol, XLogP of 2.10, 2 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for N-[chloro(3,3-dimethylbutan-2-yl)silyl]methanamine is sourced from PubChem (CID 173059570), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).