4-(tributoxysilylmethyl)hexan-1-amine

C19H43NO3Si — CID 54334659

IUPAC4-(tributoxysilylmethyl)hexan-1-amine
SMILESCCCCO[Si](CC(CC)CCCN)(OCCCC)OCCCC
InChIInChI=1S/C19H43NO3Si/c1-5-9-15-21-24(22-16-10-6-2,23-17-11-7-3)18-19(8-4)13-12-14-20/h19H,5-18,20H2,1-4H3
InChIKeyTUPBGUXZHRKDGC-UHFFFAOYSA-N
MW361.64 g/mol
LogP5.14
Rot. Bonds18

About 4-(tributoxysilylmethyl)hexan-1-amine

4-(tributoxysilylmethyl)hexan-1-amine (PubChem CID 54334659) has the molecular formula C19H43NO3Si and a molecular weight of 361.64 g/mol. Its IUPAC name is 4-(tributoxysilylmethyl)hexan-1-amine.

Molecular Properties

Compound Name4-(tributoxysilylmethyl)hexan-1-amine
PubChem CID54334659
Molecular FormulaC19H43NO3Si
Molecular Weight361.64 g/mol
Exact Mass361.30
IUPAC Name4-(tributoxysilylmethyl)hexan-1-amine
SMILESCCCCO[Si](CC(CC)CCCN)(OCCCC)OCCCC
InChIInChI=1S/C19H43NO3Si/c1-5-9-15-21-24(22-16-10-6-2,23-17-11-7-3)18-19(8-4)13-12-14-20/h19H,5-18,20H2,1-4H3
InChIKeyTUPBGUXZHRKDGC-UHFFFAOYSA-N
XLogP5.14
TPSA53.71 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds18
Heavy Atoms24
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500361.64
LogP ≤ 55.14
H-Bond Donors ≤ 51
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 4-(tributoxysilylmethyl)hexan-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

tributoxy(2,3,3-trifluoropropyl)silane
CID 87364687
3-trihexadecoxysilylpropan-1-amine
CID 87405617
2-(butoxymethyl)pentane-1,5-diamine
CID 14177998
6-tripentoxysilylhexan-1-amine
CID 152508476
triethoxy(2-heptylundecyl)silane
CID 139707869
2-methyl-3-trihexadecoxysilylpropan-1-amine
CID 87404816
[(2R)-2-ethylhexyl]-tris[(2S)-2-ethylhexyl]silane
CID 99771332
4-hexylundecan-1-amine
CID 167174040
4-heptylundecan-1-amine
CID 146490531
4,4-dibutoxybutan-1-amine
CID 173191974
8-(2-ethylhexoxy)octan-1-amine
CID 87537137
3-[dimethoxy(undecyl)silyl]oxypropan-1-amine
CID 156751574

Frequently Asked Questions

What is the IUPAC name of 4-(tributoxysilylmethyl)hexan-1-amine?
The IUPAC name of 4-(tributoxysilylmethyl)hexan-1-amine (CID 54334659) is 4-(tributoxysilylmethyl)hexan-1-amine.
What is the SMILES notation for 4-(tributoxysilylmethyl)hexan-1-amine?
The canonical SMILES for 4-(tributoxysilylmethyl)hexan-1-amine is CCCCO[Si](CC(CC)CCCN)(OCCCC)OCCCC.
What is the InChIKey of 4-(tributoxysilylmethyl)hexan-1-amine?
The InChIKey is TUPBGUXZHRKDGC-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H43NO3Si/c1-5-9-15-21-24(22-16-10-6-2,23-17-11-7-3)18-19(8-4)13-12-14-20/h19H,5-18,20H2,1-4H3.
What are the key properties of 4-(tributoxysilylmethyl)hexan-1-amine?
4-(tributoxysilylmethyl)hexan-1-amine has a molecular weight of 361.64 g/mol, XLogP of 5.14, 18 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 4-(tributoxysilylmethyl)hexan-1-amine is sourced from PubChem (CID 54334659), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).