N-[3-[butyl(dipropoxy)silyl]propyl]-3-methoxypropan-1-amine

C17H39NO3Si — CID 142740331

IUPACN-[3-[butyl(dipropoxy)silyl]propyl]-3-methoxypropan-1-amine
SMILESCCCC[Si](CCCNCCCOC)(OCCC)OCCC
InChIInChI=1S/C17H39NO3Si/c1-5-8-16-22(20-13-6-2,21-14-7-3)17-10-12-18-11-9-15-19-4/h18H,5-17H2,1-4H3
InChIKeyRQMNIOBGPYQDRP-UHFFFAOYSA-N
MW333.59 g/mol
LogP4.10
Rot. Bonds17

About N-[3-[butyl(dipropoxy)silyl]propyl]-3-methoxypropan-1-amine

N-[3-[butyl(dipropoxy)silyl]propyl]-3-methoxypropan-1-amine (PubChem CID 142740331) has the molecular formula C17H39NO3Si and a molecular weight of 333.59 g/mol. Its IUPAC name is N-[3-[butyl(dipropoxy)silyl]propyl]-3-methoxypropan-1-amine.

Molecular Properties

Compound NameN-[3-[butyl(dipropoxy)silyl]propyl]-3-methoxypropan-1-amine
PubChem CID142740331
Molecular FormulaC17H39NO3Si
Molecular Weight333.59 g/mol
Exact Mass333.27
IUPAC NameN-[3-[butyl(dipropoxy)silyl]propyl]-3-methoxypropan-1-amine
SMILESCCCC[Si](CCCNCCCOC)(OCCC)OCCC
InChIInChI=1S/C17H39NO3Si/c1-5-8-16-22(20-13-6-2,21-14-7-3)17-10-12-18-11-9-15-19-4/h18H,5-17H2,1-4H3
InChIKeyRQMNIOBGPYQDRP-UHFFFAOYSA-N
XLogP4.10
TPSA39.72 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds17
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500333.59
LogP ≤ 54.10
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'}

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Related Compounds

3-methoxy-N-[3-[phenyl(dipropoxy)silyl]propyl]propan-1-amine
CID 142737698
3-[butyl(dimethoxy)silyl]-N-(2-ethoxyethyl)propan-1-amine
CID 142737751
N-(4-methoxybutyl)tetradecan-1-amine
CID 145085752
3-methoxy-N-[2-(2-propoxyethoxy)ethyl]propan-1-amine
CID 63685704
decyl-dipropoxy-propylsilane
CID 22228664
4-methoxy-N-(3-trimethoxysilylpropyl)butan-1-amine
CID 142739557
N-(2-hexoxyethyl)-3-methoxypropan-1-amine
CID 62599714
4-iodo-N-(3-methoxypropyl)butan-1-amine
CID 106844640
butyl-dipentoxy-propylsilane
CID 140892782
ethyl-hexadecyl-dipropoxysilane
CID 22228686
ethane;N-(2-methoxyethyl)hexan-1-amine
CID 177359501
N-butyl-4-[3-(butylamino)propyl-dimethoxysilyl]oxybutan-1-amine
CID 175131776

Frequently Asked Questions

What is the IUPAC name of N-[3-[butyl(dipropoxy)silyl]propyl]-3-methoxypropan-1-amine?
The IUPAC name of N-[3-[butyl(dipropoxy)silyl]propyl]-3-methoxypropan-1-amine (CID 142740331) is N-[3-[butyl(dipropoxy)silyl]propyl]-3-methoxypropan-1-amine.
What is the SMILES notation for N-[3-[butyl(dipropoxy)silyl]propyl]-3-methoxypropan-1-amine?
The canonical SMILES for N-[3-[butyl(dipropoxy)silyl]propyl]-3-methoxypropan-1-amine is CCCC[Si](CCCNCCCOC)(OCCC)OCCC.
What is the InChIKey of N-[3-[butyl(dipropoxy)silyl]propyl]-3-methoxypropan-1-amine?
The InChIKey is RQMNIOBGPYQDRP-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H39NO3Si/c1-5-8-16-22(20-13-6-2,21-14-7-3)17-10-12-18-11-9-15-19-4/h18H,5-17H2,1-4H3.
What are the key properties of N-[3-[butyl(dipropoxy)silyl]propyl]-3-methoxypropan-1-amine?
N-[3-[butyl(dipropoxy)silyl]propyl]-3-methoxypropan-1-amine has a molecular weight of 333.59 g/mol, XLogP of 4.10, 17 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-[3-[butyl(dipropoxy)silyl]propyl]-3-methoxypropan-1-amine is sourced from PubChem (CID 142740331), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).