N-[(dihexylamino)-dimethoxysilyl]-N-hexylhexan-1-amine

C26H58N2O2Si — CID 139816206

IUPACN-[(dihexylamino)-dimethoxysilyl]-N-hexylhexan-1-amine
SMILESCCCCCCN(CCCCCC)[Si](OC)(OC)N(CCCCCC)CCCCCC
InChIInChI=1S/C26H58N2O2Si/c1-7-11-15-19-23-27(24-20-16-12-8-2)31(29-5,30-6)28(25-21-17-13-9-3)26-22-18-14-10-4/h7-26H2,1-6H3
InChIKeyHHCVSKFYQUEGLO-UHFFFAOYSA-N
MW458.85 g/mol
LogP7.64
Rot. Bonds24

About N-[(dihexylamino)-dimethoxysilyl]-N-hexylhexan-1-amine

N-[(dihexylamino)-dimethoxysilyl]-N-hexylhexan-1-amine (PubChem CID 139816206) has the molecular formula C26H58N2O2Si and a molecular weight of 458.85 g/mol. Its IUPAC name is N-[(dihexylamino)-dimethoxysilyl]-N-hexylhexan-1-amine.

Molecular Properties

Compound NameN-[(dihexylamino)-dimethoxysilyl]-N-hexylhexan-1-amine
PubChem CID139816206
Molecular FormulaC26H58N2O2Si
Molecular Weight458.85 g/mol
Exact Mass458.43
IUPAC NameN-[(dihexylamino)-dimethoxysilyl]-N-hexylhexan-1-amine
SMILESCCCCCCN(CCCCCC)[Si](OC)(OC)N(CCCCCC)CCCCCC
InChIInChI=1S/C26H58N2O2Si/c1-7-11-15-19-23-27(24-20-16-12-8-2)31(29-5,30-6)28(25-21-17-13-9-3)26-22-18-14-10-4/h7-26H2,1-6H3
InChIKeyHHCVSKFYQUEGLO-UHFFFAOYSA-N
XLogP7.64
TPSA24.94 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds24
Heavy Atoms31
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500458.85
LogP ≤ 57.64
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

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

Analyze N-[(dihexylamino)-dimethoxysilyl]-N-hexylhexan-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-[(dipentylamino)-dimethoxysilyl]-N-pentylpentan-1-amine
CID 139816210
N-[dimethoxy(propyl)silyl]-N-octyloctan-1-amine
CID 54243095
N-propyl-N-trimethoxysilyloctadecan-1-amine;hydrochloride
CID 173034322
N-[dimethoxy(2-methylpropyl)silyl]-N-hexylhexan-1-amine
CID 142705863
(Z)-N-propyl-N-trimethoxysilyloctadec-9-en-1-amine;hydrochloride
CID 173241581
methoxymethane;undecane
CID 174775722
N,N-dimethyldecan-1-amine;ruthenium
CID 158300226
heptane;trihydroxy(methoxy)silane
CID 174556151
N-methyl-N-(3-trimethoxysilylpropyl)decan-1-amine;hydroiodide
CID 174161924
decane;ruthenium
CID 160818595
N-methoxy-N-methylhexan-1-amine
CID 54431715
N,N-dipentylhexadecan-1-amine
CID 139723811

Frequently Asked Questions

What is the IUPAC name of N-[(dihexylamino)-dimethoxysilyl]-N-hexylhexan-1-amine?
The IUPAC name of N-[(dihexylamino)-dimethoxysilyl]-N-hexylhexan-1-amine (CID 139816206) is N-[(dihexylamino)-dimethoxysilyl]-N-hexylhexan-1-amine.
What is the SMILES notation for N-[(dihexylamino)-dimethoxysilyl]-N-hexylhexan-1-amine?
The canonical SMILES for N-[(dihexylamino)-dimethoxysilyl]-N-hexylhexan-1-amine is CCCCCCN(CCCCCC)[Si](OC)(OC)N(CCCCCC)CCCCCC.
What is the InChIKey of N-[(dihexylamino)-dimethoxysilyl]-N-hexylhexan-1-amine?
The InChIKey is HHCVSKFYQUEGLO-UHFFFAOYSA-N. The full InChI is InChI=1S/C26H58N2O2Si/c1-7-11-15-19-23-27(24-20-16-12-8-2)31(29-5,30-6)28(25-21-17-13-9-3)26-22-18-14-10-4/h7-26H2,1-6H3.
What are the key properties of N-[(dihexylamino)-dimethoxysilyl]-N-hexylhexan-1-amine?
N-[(dihexylamino)-dimethoxysilyl]-N-hexylhexan-1-amine has a molecular weight of 458.85 g/mol, XLogP of 7.64, 24 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-[(dihexylamino)-dimethoxysilyl]-N-hexylhexan-1-amine is sourced from PubChem (CID 139816206), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).