N-[butyl-[di(propan-2-yl)amino]-ethenylsilyl]-N-propan-2-ylpropan-2-amine

C18H40N2Si — CID 87144812

IUPACN-[butyl-[di(propan-2-yl)amino]-ethenylsilyl]-N-propan-2-ylpropan-2-amine
SMILESC=C[Si](CCCC)(N(C(C)C)C(C)C)N(C(C)C)C(C)C
InChIInChI=1S/C18H40N2Si/c1-11-13-14-21(12-2,19(15(3)4)16(5)6)20(17(7)8)18(9)10/h12,15-18H,2,11,13-14H2,1,3-10H3
InChIKeyHMWYQIGKIRFIFC-UHFFFAOYSA-N
MW312.62 g/mol
LogP5.19
Rot. Bonds10

About N-[butyl-[di(propan-2-yl)amino]-ethenylsilyl]-N-propan-2-ylpropan-2-amine

N-[butyl-[di(propan-2-yl)amino]-ethenylsilyl]-N-propan-2-ylpropan-2-amine (PubChem CID 87144812) has the molecular formula C18H40N2Si and a molecular weight of 312.62 g/mol. Its IUPAC name is N-[butyl-[di(propan-2-yl)amino]-ethenylsilyl]-N-propan-2-ylpropan-2-amine.

Molecular Properties

Compound NameN-[butyl-[di(propan-2-yl)amino]-ethenylsilyl]-N-propan-2-ylpropan-2-amine
PubChem CID87144812
Molecular FormulaC18H40N2Si
Molecular Weight312.62 g/mol
Exact Mass312.30
IUPAC NameN-[butyl-[di(propan-2-yl)amino]-ethenylsilyl]-N-propan-2-ylpropan-2-amine
SMILESC=C[Si](CCCC)(N(C(C)C)C(C)C)N(C(C)C)C(C)C
InChIInChI=1S/C18H40N2Si/c1-11-13-14-21(12-2,19(15(3)4)16(5)6)20(17(7)8)18(9)10/h12,15-18H,2,11,13-14H2,1,3-10H3
InChIKeyHMWYQIGKIRFIFC-UHFFFAOYSA-N
XLogP5.19
TPSA6.48 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds10
Heavy Atoms21
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500312.62
LogP ≤ 55.19
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

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

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Frequently Asked Questions

What is the IUPAC name of N-[butyl-[di(propan-2-yl)amino]-ethenylsilyl]-N-propan-2-ylpropan-2-amine?
The IUPAC name of N-[butyl-[di(propan-2-yl)amino]-ethenylsilyl]-N-propan-2-ylpropan-2-amine (CID 87144812) is N-[butyl-[di(propan-2-yl)amino]-ethenylsilyl]-N-propan-2-ylpropan-2-amine.
What is the SMILES notation for N-[butyl-[di(propan-2-yl)amino]-ethenylsilyl]-N-propan-2-ylpropan-2-amine?
The canonical SMILES for N-[butyl-[di(propan-2-yl)amino]-ethenylsilyl]-N-propan-2-ylpropan-2-amine is C=C[Si](CCCC)(N(C(C)C)C(C)C)N(C(C)C)C(C)C.
What is the InChIKey of N-[butyl-[di(propan-2-yl)amino]-ethenylsilyl]-N-propan-2-ylpropan-2-amine?
The InChIKey is HMWYQIGKIRFIFC-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H40N2Si/c1-11-13-14-21(12-2,19(15(3)4)16(5)6)20(17(7)8)18(9)10/h12,15-18H,2,11,13-14H2,1,3-10H3.
What are the key properties of N-[butyl-[di(propan-2-yl)amino]-ethenylsilyl]-N-propan-2-ylpropan-2-amine?
N-[butyl-[di(propan-2-yl)amino]-ethenylsilyl]-N-propan-2-ylpropan-2-amine has a molecular weight of 312.62 g/mol, XLogP of 5.19, 10 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-[butyl-[di(propan-2-yl)amino]-ethenylsilyl]-N-propan-2-ylpropan-2-amine is sourced from PubChem (CID 87144812), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).