3-tert-butyl-N,N,4,4-tetramethyl-3-silylpentan-2-amine

C13H31NSi — CID 173064954

IUPAC3-tert-butyl-N,N,4,4-tetramethyl-3-silylpentan-2-amine
SMILESCC(N(C)C)C([SiH3])(C(C)(C)C)C(C)(C)C
InChIInChI=1S/C13H31NSi/c1-10(14(8)9)13(15,11(2,3)4)12(5,6)7/h10H,1-9,15H3
InChIKeyMAJULYQKFHRSMN-UHFFFAOYSA-N
MW229.48 g/mol
LogP2.55
Rot. Bonds2

About 3-tert-butyl-N,N,4,4-tetramethyl-3-silylpentan-2-amine

3-tert-butyl-N,N,4,4-tetramethyl-3-silylpentan-2-amine (PubChem CID 173064954) has the molecular formula C13H31NSi and a molecular weight of 229.48 g/mol. Its IUPAC name is 3-tert-butyl-N,N,4,4-tetramethyl-3-silylpentan-2-amine.

Molecular Properties

Compound Name3-tert-butyl-N,N,4,4-tetramethyl-3-silylpentan-2-amine
PubChem CID173064954
Molecular FormulaC13H31NSi
Molecular Weight229.48 g/mol
Exact Mass229.22
IUPAC Name3-tert-butyl-N,N,4,4-tetramethyl-3-silylpentan-2-amine
SMILESCC(N(C)C)C([SiH3])(C(C)(C)C)C(C)(C)C
InChIInChI=1S/C13H31NSi/c1-10(14(8)9)13(15,11(2,3)4)12(5,6)7/h10H,1-9,15H3
InChIKeyMAJULYQKFHRSMN-UHFFFAOYSA-N
XLogP2.55
TPSA3.24 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds2
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500229.48
LogP ≤ 52.55
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

Computed Properties (RDKit)

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

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Frequently Asked Questions

What is the IUPAC name of 3-tert-butyl-N,N,4,4-tetramethyl-3-silylpentan-2-amine?
The IUPAC name of 3-tert-butyl-N,N,4,4-tetramethyl-3-silylpentan-2-amine (CID 173064954) is 3-tert-butyl-N,N,4,4-tetramethyl-3-silylpentan-2-amine.
What is the SMILES notation for 3-tert-butyl-N,N,4,4-tetramethyl-3-silylpentan-2-amine?
The canonical SMILES for 3-tert-butyl-N,N,4,4-tetramethyl-3-silylpentan-2-amine is CC(N(C)C)C([SiH3])(C(C)(C)C)C(C)(C)C.
What is the InChIKey of 3-tert-butyl-N,N,4,4-tetramethyl-3-silylpentan-2-amine?
The InChIKey is MAJULYQKFHRSMN-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H31NSi/c1-10(14(8)9)13(15,11(2,3)4)12(5,6)7/h10H,1-9,15H3.
What are the key properties of 3-tert-butyl-N,N,4,4-tetramethyl-3-silylpentan-2-amine?
3-tert-butyl-N,N,4,4-tetramethyl-3-silylpentan-2-amine has a molecular weight of 229.48 g/mol, XLogP of 2.55, 2 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 3-tert-butyl-N,N,4,4-tetramethyl-3-silylpentan-2-amine is sourced from PubChem (CID 173064954), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).