N-butyl-N-[ethoxy(dihydroxy)silyl]oxybutan-1-amine

C10H25NO4Si — CID 174731022

IUPACN-butyl-N-[ethoxy(dihydroxy)silyl]oxybutan-1-amine
SMILESCCCCN(CCCC)O[Si](O)(O)OCC
InChIInChI=1S/C10H25NO4Si/c1-4-7-9-11(10-8-5-2)15-16(12,13)14-6-3/h12-13H,4-10H2,1-3H3
InChIKeyGHQSOAAHBHHUGX-UHFFFAOYSA-N
MW251.40 g/mol
LogP1.28
Rot. Bonds10

About N-butyl-N-[ethoxy(dihydroxy)silyl]oxybutan-1-amine

N-butyl-N-[ethoxy(dihydroxy)silyl]oxybutan-1-amine (PubChem CID 174731022) has the molecular formula C10H25NO4Si and a molecular weight of 251.40 g/mol. Its IUPAC name is N-butyl-N-[ethoxy(dihydroxy)silyl]oxybutan-1-amine.

Molecular Properties

Compound NameN-butyl-N-[ethoxy(dihydroxy)silyl]oxybutan-1-amine
PubChem CID174731022
Molecular FormulaC10H25NO4Si
Molecular Weight251.40 g/mol
Exact Mass251.16
IUPAC NameN-butyl-N-[ethoxy(dihydroxy)silyl]oxybutan-1-amine
SMILESCCCCN(CCCC)O[Si](O)(O)OCC
InChIInChI=1S/C10H25NO4Si/c1-4-7-9-11(10-8-5-2)15-16(12,13)14-6-3/h12-13H,4-10H2,1-3H3
InChIKeyGHQSOAAHBHHUGX-UHFFFAOYSA-N
XLogP1.28
TPSA62.16 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds10
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500251.40
LogP ≤ 51.28
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

Computed Properties (RDKit)

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

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Frequently Asked Questions

What is the IUPAC name of N-butyl-N-[ethoxy(dihydroxy)silyl]oxybutan-1-amine?
The IUPAC name of N-butyl-N-[ethoxy(dihydroxy)silyl]oxybutan-1-amine (CID 174731022) is N-butyl-N-[ethoxy(dihydroxy)silyl]oxybutan-1-amine.
What is the SMILES notation for N-butyl-N-[ethoxy(dihydroxy)silyl]oxybutan-1-amine?
The canonical SMILES for N-butyl-N-[ethoxy(dihydroxy)silyl]oxybutan-1-amine is CCCCN(CCCC)O[Si](O)(O)OCC.
What is the InChIKey of N-butyl-N-[ethoxy(dihydroxy)silyl]oxybutan-1-amine?
The InChIKey is GHQSOAAHBHHUGX-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H25NO4Si/c1-4-7-9-11(10-8-5-2)15-16(12,13)14-6-3/h12-13H,4-10H2,1-3H3.
What are the key properties of N-butyl-N-[ethoxy(dihydroxy)silyl]oxybutan-1-amine?
N-butyl-N-[ethoxy(dihydroxy)silyl]oxybutan-1-amine has a molecular weight of 251.40 g/mol, XLogP of 1.28, 10 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N-butyl-N-[ethoxy(dihydroxy)silyl]oxybutan-1-amine is sourced from PubChem (CID 174731022), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).