1-difluorosilyl-N-methylbutan-1-amine

C5H13F2NSi — CID 173089238

IUPAC1-difluorosilyl-N-methylbutan-1-amine
SMILESCCCC(NC)[SiH](F)F
InChIInChI=1S/C5H13F2NSi/c1-3-4-5(8-2)9(6)7/h5,8-9H,3-4H2,1-2H3
InChIKeyVLLNBUDRFWIIGA-UHFFFAOYSA-N
MW153.25 g/mol
LogP1.07
Rot. Bonds4

About 1-difluorosilyl-N-methylbutan-1-amine

1-difluorosilyl-N-methylbutan-1-amine (PubChem CID 173089238) has the molecular formula C5H13F2NSi and a molecular weight of 153.25 g/mol. Its IUPAC name is 1-difluorosilyl-N-methylbutan-1-amine.

Molecular Properties

Compound Name1-difluorosilyl-N-methylbutan-1-amine
PubChem CID173089238
Molecular FormulaC5H13F2NSi
Molecular Weight153.25 g/mol
Exact Mass153.08
IUPAC Name1-difluorosilyl-N-methylbutan-1-amine
SMILESCCCC(NC)[SiH](F)F
InChIInChI=1S/C5H13F2NSi/c1-3-4-5(8-2)9(6)7/h5,8-9H,3-4H2,1-2H3
InChIKeyVLLNBUDRFWIIGA-UHFFFAOYSA-N
XLogP1.07
TPSA12.03 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds4
Heavy Atoms9
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500153.25
LogP ≤ 51.07
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 1-difluorosilyl-N-methylbutan-1-amine?
The IUPAC name of 1-difluorosilyl-N-methylbutan-1-amine (CID 173089238) is 1-difluorosilyl-N-methylbutan-1-amine.
What is the SMILES notation for 1-difluorosilyl-N-methylbutan-1-amine?
The canonical SMILES for 1-difluorosilyl-N-methylbutan-1-amine is CCCC(NC)[SiH](F)F.
What is the InChIKey of 1-difluorosilyl-N-methylbutan-1-amine?
The InChIKey is VLLNBUDRFWIIGA-UHFFFAOYSA-N. The full InChI is InChI=1S/C5H13F2NSi/c1-3-4-5(8-2)9(6)7/h5,8-9H,3-4H2,1-2H3.
What are the key properties of 1-difluorosilyl-N-methylbutan-1-amine?
1-difluorosilyl-N-methylbutan-1-amine has a molecular weight of 153.25 g/mol, XLogP of 1.07, 4 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 1-difluorosilyl-N-methylbutan-1-amine is sourced from PubChem (CID 173089238), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).