N-[1-(furan-2-yl)pentyl]-N-trimethylsilyloctan-1-amine

C20H39NOSi — CID 10404831

IUPACN-[1-(furan-2-yl)pentyl]-N-trimethylsilyloctan-1-amine
SMILESCCCCCCCCN(C(CCCC)c1ccco1)[Si](C)(C)C
InChIInChI=1S/C20H39NOSi/c1-6-8-10-11-12-13-17-21(23(3,4)5)19(15-9-7-2)20-16-14-18-22-20/h14,16,18-19H,6-13,15,17H2,1-5H3
InChIKeyIVSAZGPZRZKDJJ-UHFFFAOYSA-N
MW337.62 g/mol
LogP7.01
Rot. Bonds13

About N-[1-(furan-2-yl)pentyl]-N-trimethylsilyloctan-1-amine

N-[1-(furan-2-yl)pentyl]-N-trimethylsilyloctan-1-amine (PubChem CID 10404831) has the molecular formula C20H39NOSi and a molecular weight of 337.62 g/mol. Its IUPAC name is N-[1-(furan-2-yl)pentyl]-N-trimethylsilyloctan-1-amine.

Molecular Properties

Compound NameN-[1-(furan-2-yl)pentyl]-N-trimethylsilyloctan-1-amine
PubChem CID10404831
Molecular FormulaC20H39NOSi
Molecular Weight337.62 g/mol
Exact Mass337.28
IUPAC NameN-[1-(furan-2-yl)pentyl]-N-trimethylsilyloctan-1-amine
SMILESCCCCCCCCN(C(CCCC)c1ccco1)[Si](C)(C)C
InChIInChI=1S/C20H39NOSi/c1-6-8-10-11-12-13-17-21(23(3,4)5)19(15-9-7-2)20-16-14-18-22-20/h14,16,18-19H,6-13,15,17H2,1-5H3
InChIKeyIVSAZGPZRZKDJJ-UHFFFAOYSA-N
XLogP7.01
TPSA16.38 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds13
Heavy Atoms23
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500337.62
LogP ≤ 57.01
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

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

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Frequently Asked Questions

What is the IUPAC name of N-[1-(furan-2-yl)pentyl]-N-trimethylsilyloctan-1-amine?
The IUPAC name of N-[1-(furan-2-yl)pentyl]-N-trimethylsilyloctan-1-amine (CID 10404831) is N-[1-(furan-2-yl)pentyl]-N-trimethylsilyloctan-1-amine.
What is the SMILES notation for N-[1-(furan-2-yl)pentyl]-N-trimethylsilyloctan-1-amine?
The canonical SMILES for N-[1-(furan-2-yl)pentyl]-N-trimethylsilyloctan-1-amine is CCCCCCCCN(C(CCCC)c1ccco1)[Si](C)(C)C.
What is the InChIKey of N-[1-(furan-2-yl)pentyl]-N-trimethylsilyloctan-1-amine?
The InChIKey is IVSAZGPZRZKDJJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H39NOSi/c1-6-8-10-11-12-13-17-21(23(3,4)5)19(15-9-7-2)20-16-14-18-22-20/h14,16,18-19H,6-13,15,17H2,1-5H3.
What are the key properties of N-[1-(furan-2-yl)pentyl]-N-trimethylsilyloctan-1-amine?
N-[1-(furan-2-yl)pentyl]-N-trimethylsilyloctan-1-amine has a molecular weight of 337.62 g/mol, XLogP of 7.01, 13 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-[1-(furan-2-yl)pentyl]-N-trimethylsilyloctan-1-amine is sourced from PubChem (CID 10404831), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).