N-[2-[methyl(propan-2-yl)silyl]ethyl]-N-methylsulfanylpropan-1-amine

C10H25NSSi — CID 174011981

IUPACN-[2-[methyl(propan-2-yl)silyl]ethyl]-N-methylsulfanylpropan-1-amine
SMILESCCCN(CC[SiH](C)C(C)C)SC
InChIInChI=1S/C10H25NSSi/c1-6-7-11(12-4)8-9-13(5)10(2)3/h10,13H,6-9H2,1-5H3
InChIKeyRFKKVUYHIFMOBU-UHFFFAOYSA-N
MW219.47 g/mol
LogP3.24
Rot. Bonds7

About N-[2-[methyl(propan-2-yl)silyl]ethyl]-N-methylsulfanylpropan-1-amine

N-[2-[methyl(propan-2-yl)silyl]ethyl]-N-methylsulfanylpropan-1-amine (PubChem CID 174011981) has the molecular formula C10H25NSSi and a molecular weight of 219.47 g/mol. Its IUPAC name is N-[2-[methyl(propan-2-yl)silyl]ethyl]-N-methylsulfanylpropan-1-amine.

Molecular Properties

Compound NameN-[2-[methyl(propan-2-yl)silyl]ethyl]-N-methylsulfanylpropan-1-amine
PubChem CID174011981
Molecular FormulaC10H25NSSi
Molecular Weight219.47 g/mol
Exact Mass219.15
IUPAC NameN-[2-[methyl(propan-2-yl)silyl]ethyl]-N-methylsulfanylpropan-1-amine
SMILESCCCN(CC[SiH](C)C(C)C)SC
InChIInChI=1S/C10H25NSSi/c1-6-7-11(12-4)8-9-13(5)10(2)3/h10,13H,6-9H2,1-5H3
InChIKeyRFKKVUYHIFMOBU-UHFFFAOYSA-N
XLogP3.24
TPSA3.24 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds7
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500219.47
LogP ≤ 53.24
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

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

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Frequently Asked Questions

What is the IUPAC name of N-[2-[methyl(propan-2-yl)silyl]ethyl]-N-methylsulfanylpropan-1-amine?
The IUPAC name of N-[2-[methyl(propan-2-yl)silyl]ethyl]-N-methylsulfanylpropan-1-amine (CID 174011981) is N-[2-[methyl(propan-2-yl)silyl]ethyl]-N-methylsulfanylpropan-1-amine.
What is the SMILES notation for N-[2-[methyl(propan-2-yl)silyl]ethyl]-N-methylsulfanylpropan-1-amine?
The canonical SMILES for N-[2-[methyl(propan-2-yl)silyl]ethyl]-N-methylsulfanylpropan-1-amine is CCCN(CC[SiH](C)C(C)C)SC.
What is the InChIKey of N-[2-[methyl(propan-2-yl)silyl]ethyl]-N-methylsulfanylpropan-1-amine?
The InChIKey is RFKKVUYHIFMOBU-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H25NSSi/c1-6-7-11(12-4)8-9-13(5)10(2)3/h10,13H,6-9H2,1-5H3.
What are the key properties of N-[2-[methyl(propan-2-yl)silyl]ethyl]-N-methylsulfanylpropan-1-amine?
N-[2-[methyl(propan-2-yl)silyl]ethyl]-N-methylsulfanylpropan-1-amine has a molecular weight of 219.47 g/mol, XLogP of 3.24, 7 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-[2-[methyl(propan-2-yl)silyl]ethyl]-N-methylsulfanylpropan-1-amine is sourced from PubChem (CID 174011981), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).