(E)-N,N-dicyclohexyl-3-trimethylsilylprop-2-enamide

C18H33NOSi — CID 154707817

IUPAC(E)-N,N-dicyclohexyl-3-trimethylsilylprop-2-enamide
SMILESC[Si](C)(C)/C=C/C(=O)N(C1CCCCC1)C1CCCCC1
InChIInChI=1S/C18H33NOSi/c1-21(2,3)15-14-18(20)19(16-10-6-4-7-11-16)17-12-8-5-9-13-17/h14-17H,4-13H2,1-3H3/b15-14+
InChIKeyLUTJWGNCDOYNBZ-CCEZHUSRSA-N
MW307.55 g/mol
LogP4.91
Rot. Bonds4

About (E)-N,N-dicyclohexyl-3-trimethylsilylprop-2-enamide

(E)-N,N-dicyclohexyl-3-trimethylsilylprop-2-enamide (PubChem CID 154707817) has the molecular formula C18H33NOSi and a molecular weight of 307.55 g/mol. Its IUPAC name is (E)-N,N-dicyclohexyl-3-trimethylsilylprop-2-enamide.

Molecular Properties

Compound Name(E)-N,N-dicyclohexyl-3-trimethylsilylprop-2-enamide
PubChem CID154707817
Molecular FormulaC18H33NOSi
Molecular Weight307.55 g/mol
Exact Mass307.23
IUPAC Name(E)-N,N-dicyclohexyl-3-trimethylsilylprop-2-enamide
SMILESC[Si](C)(C)/C=C/C(=O)N(C1CCCCC1)C1CCCCC1
InChIInChI=1S/C18H33NOSi/c1-21(2,3)15-14-18(20)19(16-10-6-4-7-11-16)17-12-8-5-9-13-17/h14-17H,4-13H2,1-3H3/b15-14+
InChIKeyLUTJWGNCDOYNBZ-CCEZHUSRSA-N
XLogP4.91
TPSA20.31 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds4
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500307.55
LogP ≤ 54.91
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

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 (E)-N,N-dicyclohexyl-3-trimethylsilylprop-2-enamide?
The IUPAC name of (E)-N,N-dicyclohexyl-3-trimethylsilylprop-2-enamide (CID 154707817) is (E)-N,N-dicyclohexyl-3-trimethylsilylprop-2-enamide.
What is the SMILES notation for (E)-N,N-dicyclohexyl-3-trimethylsilylprop-2-enamide?
The canonical SMILES for (E)-N,N-dicyclohexyl-3-trimethylsilylprop-2-enamide is C[Si](C)(C)/C=C/C(=O)N(C1CCCCC1)C1CCCCC1.
What is the InChIKey of (E)-N,N-dicyclohexyl-3-trimethylsilylprop-2-enamide?
The InChIKey is LUTJWGNCDOYNBZ-CCEZHUSRSA-N. The full InChI is InChI=1S/C18H33NOSi/c1-21(2,3)15-14-18(20)19(16-10-6-4-7-11-16)17-12-8-5-9-13-17/h14-17H,4-13H2,1-3H3/b15-14+.
What are the key properties of (E)-N,N-dicyclohexyl-3-trimethylsilylprop-2-enamide?
(E)-N,N-dicyclohexyl-3-trimethylsilylprop-2-enamide has a molecular weight of 307.55 g/mol, XLogP of 4.91, 4 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for (E)-N,N-dicyclohexyl-3-trimethylsilylprop-2-enamide is sourced from PubChem (CID 154707817), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).