3-phenyl-5-trimethoxysilylpentane-1,3-diamine

C14H26N2O3Si — CID 174890020

IUPAC3-phenyl-5-trimethoxysilylpentane-1,3-diamine
SMILESCO[Si](CCC(N)(CCN)c1ccccc1)(OC)OC
InChIInChI=1S/C14H26N2O3Si/c1-17-20(18-2,19-3)12-10-14(16,9-11-15)13-7-5-4-6-8-13/h4-8H,9-12,15-16H2,1-3H3
InChIKeyCMFFNKIGCPFZBX-UHFFFAOYSA-N
MW298.46 g/mol
LogP1.46
Rot. Bonds9

About 3-phenyl-5-trimethoxysilylpentane-1,3-diamine

3-phenyl-5-trimethoxysilylpentane-1,3-diamine (PubChem CID 174890020) has the molecular formula C14H26N2O3Si and a molecular weight of 298.46 g/mol. Its IUPAC name is 3-phenyl-5-trimethoxysilylpentane-1,3-diamine.

Molecular Properties

Compound Name3-phenyl-5-trimethoxysilylpentane-1,3-diamine
PubChem CID174890020
Molecular FormulaC14H26N2O3Si
Molecular Weight298.46 g/mol
Exact Mass298.17
IUPAC Name3-phenyl-5-trimethoxysilylpentane-1,3-diamine
SMILESCO[Si](CCC(N)(CCN)c1ccccc1)(OC)OC
InChIInChI=1S/C14H26N2O3Si/c1-17-20(18-2,19-3)12-10-14(16,9-11-15)13-7-5-4-6-8-13/h4-8H,9-12,15-16H2,1-3H3
InChIKeyCMFFNKIGCPFZBX-UHFFFAOYSA-N
XLogP1.46
TPSA79.73 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds9
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500298.46
LogP ≤ 51.46
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

Computed Properties (RDKit)

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

Analyze 3-phenyl-5-trimethoxysilylpentane-1,3-diamine 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

1,1-diphenyl-N'-(3-trimethoxysilylpropyl)methanediamine
CID 19877442
1,1-bis(3-methylphenyl)-3-trimethoxysilylpropan-1-amine
CID 21018722
3-amino-1-(2-methoxyphenoxy)-1-phenylpropan-1-ol
CID 69398907
3,3-dimethoxy-3-(3-methoxyphenyl)propan-1-amine
CID 94684684
methanol;toluene;3-trimethoxysilylpropan-1-amine
CID 174567080
3,3,3-triphenylpropan-1-amine
CID 10125450
3-[dimethoxy(2-phenylethoxy)silyl]propan-1-amine
CID 66744163
3-[dimethoxy(phenylmethoxy)silyl]propan-1-amine
CID 66586388
CID 165388786
CID 165388786
3-phenylhexan-3-amine
CID 60794511
N'-[2-[dimethoxy(2-phenylethyl)silyl]oxyethyl]ethane-1,2-diamine
CID 53427353
N'-[3-[dimethoxy(2-phenylethyl)silyl]oxypropyl]ethane-1,2-diamine
CID 66688681

Frequently Asked Questions

What is the IUPAC name of 3-phenyl-5-trimethoxysilylpentane-1,3-diamine?
The IUPAC name of 3-phenyl-5-trimethoxysilylpentane-1,3-diamine (CID 174890020) is 3-phenyl-5-trimethoxysilylpentane-1,3-diamine.
What is the SMILES notation for 3-phenyl-5-trimethoxysilylpentane-1,3-diamine?
The canonical SMILES for 3-phenyl-5-trimethoxysilylpentane-1,3-diamine is CO[Si](CCC(N)(CCN)c1ccccc1)(OC)OC.
What is the InChIKey of 3-phenyl-5-trimethoxysilylpentane-1,3-diamine?
The InChIKey is CMFFNKIGCPFZBX-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H26N2O3Si/c1-17-20(18-2,19-3)12-10-14(16,9-11-15)13-7-5-4-6-8-13/h4-8H,9-12,15-16H2,1-3H3.
What are the key properties of 3-phenyl-5-trimethoxysilylpentane-1,3-diamine?
3-phenyl-5-trimethoxysilylpentane-1,3-diamine has a molecular weight of 298.46 g/mol, XLogP of 1.46, 9 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 3-phenyl-5-trimethoxysilylpentane-1,3-diamine is sourced from PubChem (CID 174890020), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).