N-[butyl(diethoxy)silyl]-2-methyl-N-(2-methylpropyl)propan-1-amine

C16H37NO2Si — CID 87635244

IUPACN-[butyl(diethoxy)silyl]-2-methyl-N-(2-methylpropyl)propan-1-amine
SMILESCCCC[Si](OCC)(OCC)N(CC(C)C)CC(C)C
InChIInChI=1S/C16H37NO2Si/c1-8-11-12-20(18-9-2,19-10-3)17(13-15(4)5)14-16(6)7/h15-16H,8-14H2,1-7H3
InChIKeyINXMBQUPCDXWNS-UHFFFAOYSA-N
MW303.56 g/mol
LogP4.41
Rot. Bonds12

About N-[butyl(diethoxy)silyl]-2-methyl-N-(2-methylpropyl)propan-1-amine

N-[butyl(diethoxy)silyl]-2-methyl-N-(2-methylpropyl)propan-1-amine (PubChem CID 87635244) has the molecular formula C16H37NO2Si and a molecular weight of 303.56 g/mol. Its IUPAC name is N-[butyl(diethoxy)silyl]-2-methyl-N-(2-methylpropyl)propan-1-amine.

Molecular Properties

Compound NameN-[butyl(diethoxy)silyl]-2-methyl-N-(2-methylpropyl)propan-1-amine
PubChem CID87635244
Molecular FormulaC16H37NO2Si
Molecular Weight303.56 g/mol
Exact Mass303.26
IUPAC NameN-[butyl(diethoxy)silyl]-2-methyl-N-(2-methylpropyl)propan-1-amine
SMILESCCCC[Si](OCC)(OCC)N(CC(C)C)CC(C)C
InChIInChI=1S/C16H37NO2Si/c1-8-11-12-20(18-9-2,19-10-3)17(13-15(4)5)14-16(6)7/h15-16H,8-14H2,1-7H3
InChIKeyINXMBQUPCDXWNS-UHFFFAOYSA-N
XLogP4.41
TPSA21.70 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds12
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500303.56
LogP ≤ 54.41
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

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

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Related Compounds

butan-2-yl-butyl-diethoxysilane
CID 23358225
N-[butyl(dimethoxy)silyl]-N-propan-2-ylpropan-2-amine
CID 87634740
N-[butyl(dimethoxy)silyl]-N-ethylethanamine
CID 87635051
N-bromo-2-methyl-N-(3-triethoxysilylpropyl)propan-1-amine
CID 175043415
dibromo-butyl-ethoxysilane
CID 140745096
butyl-diethoxy-iodosilane
CID 154487050
butyl-diethoxy-tetradecylsilane
CID 139614088
ethoxy-dimethyl-(7-methyloctyl)silane
CID 139725717
ethoxy-methyl-octyl-propan-2-yloxysilane
CID 175038920
2,4-dimethylpentane;pentane
CID 161023213
N,N-bis(2-methylpropyl)octan-3-amine
CID 130409635
N-propyl-N-triethoxysilylbutan-1-amine
CID 175342889

Frequently Asked Questions

What is the IUPAC name of N-[butyl(diethoxy)silyl]-2-methyl-N-(2-methylpropyl)propan-1-amine?
The IUPAC name of N-[butyl(diethoxy)silyl]-2-methyl-N-(2-methylpropyl)propan-1-amine (CID 87635244) is N-[butyl(diethoxy)silyl]-2-methyl-N-(2-methylpropyl)propan-1-amine.
What is the SMILES notation for N-[butyl(diethoxy)silyl]-2-methyl-N-(2-methylpropyl)propan-1-amine?
The canonical SMILES for N-[butyl(diethoxy)silyl]-2-methyl-N-(2-methylpropyl)propan-1-amine is CCCC[Si](OCC)(OCC)N(CC(C)C)CC(C)C.
What is the InChIKey of N-[butyl(diethoxy)silyl]-2-methyl-N-(2-methylpropyl)propan-1-amine?
The InChIKey is INXMBQUPCDXWNS-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H37NO2Si/c1-8-11-12-20(18-9-2,19-10-3)17(13-15(4)5)14-16(6)7/h15-16H,8-14H2,1-7H3.
What are the key properties of N-[butyl(diethoxy)silyl]-2-methyl-N-(2-methylpropyl)propan-1-amine?
N-[butyl(diethoxy)silyl]-2-methyl-N-(2-methylpropyl)propan-1-amine has a molecular weight of 303.56 g/mol, XLogP of 4.41, 12 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-[butyl(diethoxy)silyl]-2-methyl-N-(2-methylpropyl)propan-1-amine is sourced from PubChem (CID 87635244), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).