N-propyl-N-[3-tri(propan-2-yloxy)silylpropyl]prop-2-enamide

C18H37NO4Si — CID 23116907

IUPACN-propyl-N-[3-tri(propan-2-yloxy)silylpropyl]prop-2-enamide
SMILESC=CC(=O)N(CCC)CCC[Si](OC(C)C)(OC(C)C)OC(C)C
InChIInChI=1S/C18H37NO4Si/c1-9-12-19(18(20)10-2)13-11-14-24(21-15(3)4,22-16(5)6)23-17(7)8/h10,15-17H,2,9,11-14H2,1,3-8H3
InChIKeyIYQNVFADYQHHDZ-UHFFFAOYSA-N
MW359.58 g/mol
LogP4.01
Rot. Bonds13

About N-propyl-N-[3-tri(propan-2-yloxy)silylpropyl]prop-2-enamide

N-propyl-N-[3-tri(propan-2-yloxy)silylpropyl]prop-2-enamide (PubChem CID 23116907) has the molecular formula C18H37NO4Si and a molecular weight of 359.58 g/mol. Its IUPAC name is N-propyl-N-[3-tri(propan-2-yloxy)silylpropyl]prop-2-enamide.

Molecular Properties

Compound NameN-propyl-N-[3-tri(propan-2-yloxy)silylpropyl]prop-2-enamide
PubChem CID23116907
Molecular FormulaC18H37NO4Si
Molecular Weight359.58 g/mol
Exact Mass359.25
IUPAC NameN-propyl-N-[3-tri(propan-2-yloxy)silylpropyl]prop-2-enamide
SMILESC=CC(=O)N(CCC)CCC[Si](OC(C)C)(OC(C)C)OC(C)C
InChIInChI=1S/C18H37NO4Si/c1-9-12-19(18(20)10-2)13-11-14-24(21-15(3)4,22-16(5)6)23-17(7)8/h10,15-17H,2,9,11-14H2,1,3-8H3
InChIKeyIYQNVFADYQHHDZ-UHFFFAOYSA-N
XLogP4.01
TPSA48.00 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds13
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500359.58
LogP ≤ 54.01
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'heavy_metal', 'substructure': 'N/A'}, {'alert_name': 'Michael_acceptor_1', 'substructure': 'N/A'}

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Frequently Asked Questions

What is the IUPAC name of N-propyl-N-[3-tri(propan-2-yloxy)silylpropyl]prop-2-enamide?
The IUPAC name of N-propyl-N-[3-tri(propan-2-yloxy)silylpropyl]prop-2-enamide (CID 23116907) is N-propyl-N-[3-tri(propan-2-yloxy)silylpropyl]prop-2-enamide.
What is the SMILES notation for N-propyl-N-[3-tri(propan-2-yloxy)silylpropyl]prop-2-enamide?
The canonical SMILES for N-propyl-N-[3-tri(propan-2-yloxy)silylpropyl]prop-2-enamide is C=CC(=O)N(CCC)CCC[Si](OC(C)C)(OC(C)C)OC(C)C.
What is the InChIKey of N-propyl-N-[3-tri(propan-2-yloxy)silylpropyl]prop-2-enamide?
The InChIKey is IYQNVFADYQHHDZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H37NO4Si/c1-9-12-19(18(20)10-2)13-11-14-24(21-15(3)4,22-16(5)6)23-17(7)8/h10,15-17H,2,9,11-14H2,1,3-8H3.
What are the key properties of N-propyl-N-[3-tri(propan-2-yloxy)silylpropyl]prop-2-enamide?
N-propyl-N-[3-tri(propan-2-yloxy)silylpropyl]prop-2-enamide has a molecular weight of 359.58 g/mol, XLogP of 4.01, 13 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-propyl-N-[3-tri(propan-2-yloxy)silylpropyl]prop-2-enamide is sourced from PubChem (CID 23116907), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).