N,N-bis(trimethylsilylmethyl)octadecan-1-amine

C26H59NSi2 — CID 154222277

IUPACN,N-bis(trimethylsilylmethyl)octadecan-1-amine
SMILESCCCCCCCCCCCCCCCCCCN(C[Si](C)(C)C)C[Si](C)(C)C
InChIInChI=1S/C26H59NSi2/c1-8-9-10-11-12-13-14-15-16-17-18-19-20-21-22-23-24-27(25-28(2,3)4)26-29(5,6)7/h8-26H2,1-7H3
InChIKeyCBGJHXIAFCRLJH-UHFFFAOYSA-N
MW441.94 g/mol
LogP9.30
Rot. Bonds21

About N,N-bis(trimethylsilylmethyl)octadecan-1-amine

N,N-bis(trimethylsilylmethyl)octadecan-1-amine (PubChem CID 154222277) has the molecular formula C26H59NSi2 and a molecular weight of 441.94 g/mol. Its IUPAC name is N,N-bis(trimethylsilylmethyl)octadecan-1-amine.

Molecular Properties

Compound NameN,N-bis(trimethylsilylmethyl)octadecan-1-amine
PubChem CID154222277
Molecular FormulaC26H59NSi2
Molecular Weight441.94 g/mol
Exact Mass441.42
IUPAC NameN,N-bis(trimethylsilylmethyl)octadecan-1-amine
SMILESCCCCCCCCCCCCCCCCCCN(C[Si](C)(C)C)C[Si](C)(C)C
InChIInChI=1S/C26H59NSi2/c1-8-9-10-11-12-13-14-15-16-17-18-19-20-21-22-23-24-27(25-28(2,3)4)26-29(5,6)7/h8-26H2,1-7H3
InChIKeyCBGJHXIAFCRLJH-UHFFFAOYSA-N
XLogP9.30
TPSA3.24 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds21
Heavy Atoms29
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500441.94
LogP ≤ 59.30
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

Computed Properties (RDKit)

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

Analyze N,N-bis(trimethylsilylmethyl)octadecan-1-amine with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

N,N-dipentylpentadecan-1-amine
CID 139722952
N,N-didodecyltridecan-1-amine
CID 87212898
N,N-dioctyloctan-1-amine
CID 14227
N,N-dihexyloctan-1-amine
CID 21418080
N-docosyl-N-icosyldocosan-1-amine
CID 23464225
N,N-dipentylhexadecan-1-amine
CID 139723811
N,N,N',N'-tetra(undecyl)pentane-1,5-diamine
CID 152635971
N-pentadecyl-N-pentylpentadecan-1-amine
CID 139722928
N-heptadecyl-N-heptylheptadecan-1-amine
CID 139722683
N,N-didecyltridecan-1-amine
CID 139723202
N,N-dipentyltridecan-1-amine
CID 139723521
N,N'-didodecyl-N,N'-dioctylhexane-1,6-diamine
CID 154294870

Frequently Asked Questions

What is the IUPAC name of N,N-bis(trimethylsilylmethyl)octadecan-1-amine?
The IUPAC name of N,N-bis(trimethylsilylmethyl)octadecan-1-amine (CID 154222277) is N,N-bis(trimethylsilylmethyl)octadecan-1-amine.
What is the SMILES notation for N,N-bis(trimethylsilylmethyl)octadecan-1-amine?
The canonical SMILES for N,N-bis(trimethylsilylmethyl)octadecan-1-amine is CCCCCCCCCCCCCCCCCCN(C[Si](C)(C)C)C[Si](C)(C)C.
What is the InChIKey of N,N-bis(trimethylsilylmethyl)octadecan-1-amine?
The InChIKey is CBGJHXIAFCRLJH-UHFFFAOYSA-N. The full InChI is InChI=1S/C26H59NSi2/c1-8-9-10-11-12-13-14-15-16-17-18-19-20-21-22-23-24-27(25-28(2,3)4)26-29(5,6)7/h8-26H2,1-7H3.
What are the key properties of N,N-bis(trimethylsilylmethyl)octadecan-1-amine?
N,N-bis(trimethylsilylmethyl)octadecan-1-amine has a molecular weight of 441.94 g/mol, XLogP of 9.30, 21 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for N,N-bis(trimethylsilylmethyl)octadecan-1-amine is sourced from PubChem (CID 154222277), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).