3-dipropoxysilyl-N-(3-dipropoxysilylpentyl)-N-methylpentan-1-amine

C23H53NO4Si2 — CID 154343921

IUPAC3-dipropoxysilyl-N-(3-dipropoxysilylpentyl)-N-methylpentan-1-amine
SMILESCCCO[SiH](OCCC)C(CC)CCN(C)CCC(CC)[SiH](OCCC)OCCC
InChIInChI=1S/C23H53NO4Si2/c1-8-18-25-29(26-19-9-2)22(12-5)14-16-24(7)17-15-23(13-6)30(27-20-10-3)28-21-11-4/h22-23,29-30H,8-21H2,1-7H3
InChIKeyDWOCNOGVOUDTOI-UHFFFAOYSA-N
MW463.85 g/mol
LogP5.41
Rot. Bonds22

About 3-dipropoxysilyl-N-(3-dipropoxysilylpentyl)-N-methylpentan-1-amine

3-dipropoxysilyl-N-(3-dipropoxysilylpentyl)-N-methylpentan-1-amine (PubChem CID 154343921) has the molecular formula C23H53NO4Si2 and a molecular weight of 463.85 g/mol. Its IUPAC name is 3-dipropoxysilyl-N-(3-dipropoxysilylpentyl)-N-methylpentan-1-amine.

Molecular Properties

Compound Name3-dipropoxysilyl-N-(3-dipropoxysilylpentyl)-N-methylpentan-1-amine
PubChem CID154343921
Molecular FormulaC23H53NO4Si2
Molecular Weight463.85 g/mol
Exact Mass463.35
IUPAC Name3-dipropoxysilyl-N-(3-dipropoxysilylpentyl)-N-methylpentan-1-amine
SMILESCCCO[SiH](OCCC)C(CC)CCN(C)CCC(CC)[SiH](OCCC)OCCC
InChIInChI=1S/C23H53NO4Si2/c1-8-18-25-29(26-19-9-2)22(12-5)14-16-24(7)17-15-23(13-6)30(27-20-10-3)28-21-11-4/h22-23,29-30H,8-21H2,1-7H3
InChIKeyDWOCNOGVOUDTOI-UHFFFAOYSA-N
XLogP5.41
TPSA40.16 Ų
H-Bond Donors
H-Bond Acceptors5
Rotatable Bonds22
Heavy Atoms30
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500463.85
LogP ≤ 55.41
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 105

Computed Properties (RDKit)

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

Analyze 3-dipropoxysilyl-N-(3-dipropoxysilylpentyl)-N-methylpentan-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

3-diethoxysilyl-N-(3-diethoxysilylbutyl)-N-methylbutan-1-amine
CID 154358148
4-diethoxysilylhexyl(methyl)carbamic acid
CID 173191134
4-[methyl(2-propoxyethyl)amino]butan-2-ol
CID 106456260
(3S)-N,3-dimethyl-N-propylpentan-1-amine
CID 144585217
2-dipropoxysilyl-N,N-dimethylethanamine
CID 123245425
5-diethoxysilylheptan-1-amine
CID 154490581
3-ethyl-N,4-dimethyl-N-propylpentan-1-amine
CID 155439890
N,3-dimethyl-N-propylbutan-1-amine;ethane
CID 143004983
1-phenylpropyl(dipropoxy)silane
CID 173016700
3-[3-dipropoxysilylpropyl(methyl)amino]propanoic acid
CID 173464123
methane;2-methylbutane;N-methyl-N-propylpropan-1-amine
CID 143703435
N,N'-dimethyl-N'-[2-[methyl(3-methylhexyl)amino]ethyl]-N-propylethane-1,2-diamine
CID 167171519

Frequently Asked Questions

What is the IUPAC name of 3-dipropoxysilyl-N-(3-dipropoxysilylpentyl)-N-methylpentan-1-amine?
The IUPAC name of 3-dipropoxysilyl-N-(3-dipropoxysilylpentyl)-N-methylpentan-1-amine (CID 154343921) is 3-dipropoxysilyl-N-(3-dipropoxysilylpentyl)-N-methylpentan-1-amine.
What is the SMILES notation for 3-dipropoxysilyl-N-(3-dipropoxysilylpentyl)-N-methylpentan-1-amine?
The canonical SMILES for 3-dipropoxysilyl-N-(3-dipropoxysilylpentyl)-N-methylpentan-1-amine is CCCO[SiH](OCCC)C(CC)CCN(C)CCC(CC)[SiH](OCCC)OCCC.
What is the InChIKey of 3-dipropoxysilyl-N-(3-dipropoxysilylpentyl)-N-methylpentan-1-amine?
The InChIKey is DWOCNOGVOUDTOI-UHFFFAOYSA-N. The full InChI is InChI=1S/C23H53NO4Si2/c1-8-18-25-29(26-19-9-2)22(12-5)14-16-24(7)17-15-23(13-6)30(27-20-10-3)28-21-11-4/h22-23,29-30H,8-21H2,1-7H3.
What are the key properties of 3-dipropoxysilyl-N-(3-dipropoxysilylpentyl)-N-methylpentan-1-amine?
3-dipropoxysilyl-N-(3-dipropoxysilylpentyl)-N-methylpentan-1-amine has a molecular weight of 463.85 g/mol, XLogP of 5.41, 22 rotatable bonds, 0 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 3-dipropoxysilyl-N-(3-dipropoxysilylpentyl)-N-methylpentan-1-amine is sourced from PubChem (CID 154343921), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).