N,N-bis[3-[diethoxy(methyl)silyl]propyl]prop-2-enamide

C19H41NO5Si2 — CID 14794050

IUPACN,N-bis[3-[diethoxy(methyl)silyl]propyl]prop-2-enamide
SMILESC=CC(=O)N(CCC[Si](C)(OCC)OCC)CCC[Si](C)(OCC)OCC
InChIInChI=1S/C19H41NO5Si2/c1-8-19(21)20(15-13-17-26(6,22-9-2)23-10-3)16-14-18-27(7,24-11-4)25-12-5/h8H,1,9-18H2,2-7H3
InChIKeyDZMUXXKWPAJKDU-UHFFFAOYSA-N
MW419.71 g/mol
LogP4.07
Rot. Bonds17

About N,N-bis[3-[diethoxy(methyl)silyl]propyl]prop-2-enamide

N,N-bis[3-[diethoxy(methyl)silyl]propyl]prop-2-enamide (PubChem CID 14794050) has the molecular formula C19H41NO5Si2 and a molecular weight of 419.71 g/mol. Its IUPAC name is N,N-bis[3-[diethoxy(methyl)silyl]propyl]prop-2-enamide.

Molecular Properties

Compound NameN,N-bis[3-[diethoxy(methyl)silyl]propyl]prop-2-enamide
PubChem CID14794050
Molecular FormulaC19H41NO5Si2
Molecular Weight419.71 g/mol
Exact Mass419.25
IUPAC NameN,N-bis[3-[diethoxy(methyl)silyl]propyl]prop-2-enamide
SMILESC=CC(=O)N(CCC[Si](C)(OCC)OCC)CCC[Si](C)(OCC)OCC
InChIInChI=1S/C19H41NO5Si2/c1-8-19(21)20(15-13-17-26(6,22-9-2)23-10-3)16-14-18-27(7,24-11-4)25-12-5/h8H,1,9-18H2,2-7H3
InChIKeyDZMUXXKWPAJKDU-UHFFFAOYSA-N
XLogP4.07
TPSA57.23 Ų
H-Bond Donors
H-Bond Acceptors5
Rotatable Bonds17
Heavy Atoms27
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500419.71
LogP ≤ 54.07
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 105

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,N-bis[3-[diethoxy(methyl)silyl]propyl]prop-2-enamide?
The IUPAC name of N,N-bis[3-[diethoxy(methyl)silyl]propyl]prop-2-enamide (CID 14794050) is N,N-bis[3-[diethoxy(methyl)silyl]propyl]prop-2-enamide.
What is the SMILES notation for N,N-bis[3-[diethoxy(methyl)silyl]propyl]prop-2-enamide?
The canonical SMILES for N,N-bis[3-[diethoxy(methyl)silyl]propyl]prop-2-enamide is C=CC(=O)N(CCC[Si](C)(OCC)OCC)CCC[Si](C)(OCC)OCC.
What is the InChIKey of N,N-bis[3-[diethoxy(methyl)silyl]propyl]prop-2-enamide?
The InChIKey is DZMUXXKWPAJKDU-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H41NO5Si2/c1-8-19(21)20(15-13-17-26(6,22-9-2)23-10-3)16-14-18-27(7,24-11-4)25-12-5/h8H,1,9-18H2,2-7H3.
What are the key properties of N,N-bis[3-[diethoxy(methyl)silyl]propyl]prop-2-enamide?
N,N-bis[3-[diethoxy(methyl)silyl]propyl]prop-2-enamide has a molecular weight of 419.71 g/mol, XLogP of 4.07, 17 rotatable bonds, 0 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N,N-bis[3-[diethoxy(methyl)silyl]propyl]prop-2-enamide is sourced from PubChem (CID 14794050), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).