(E)-3-[dimethyl(phenyl)silyl]-N,N-diethylhept-2-enamide

C19H31NOSi — CID 134950259

IUPAC(E)-3-[dimethyl(phenyl)silyl]-N,N-diethylhept-2-enamide
SMILESCCCC/C(=C\C(=O)N(CC)CC)[Si](C)(C)c1ccccc1
InChIInChI=1S/C19H31NOSi/c1-6-9-13-18(16-19(21)20(7-2)8-3)22(4,5)17-14-11-10-12-15-17/h10-12,14-16H,6-9,13H2,1-5H3/b18-16+
InChIKeyDRQQJDSVTUJDKV-FBMGVBCBSA-N
MW317.55 g/mol
LogP4.13
Rot. Bonds8

About (E)-3-[dimethyl(phenyl)silyl]-N,N-diethylhept-2-enamide

(E)-3-[dimethyl(phenyl)silyl]-N,N-diethylhept-2-enamide (PubChem CID 134950259) has the molecular formula C19H31NOSi and a molecular weight of 317.55 g/mol. Its IUPAC name is (E)-3-[dimethyl(phenyl)silyl]-N,N-diethylhept-2-enamide.

Molecular Properties

Compound Name(E)-3-[dimethyl(phenyl)silyl]-N,N-diethylhept-2-enamide
PubChem CID134950259
Molecular FormulaC19H31NOSi
Molecular Weight317.55 g/mol
Exact Mass317.22
IUPAC Name(E)-3-[dimethyl(phenyl)silyl]-N,N-diethylhept-2-enamide
SMILESCCCC/C(=C\C(=O)N(CC)CC)[Si](C)(C)c1ccccc1
InChIInChI=1S/C19H31NOSi/c1-6-9-13-18(16-19(21)20(7-2)8-3)22(4,5)17-14-11-10-12-15-17/h10-12,14-16H,6-9,13H2,1-5H3/b18-16+
InChIKeyDRQQJDSVTUJDKV-FBMGVBCBSA-N
XLogP4.13
TPSA20.31 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds8
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500317.55
LogP ≤ 54.13
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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Related Compounds

N-[chloro(diphenyl)silyl]methyl-N-methylacetamide
CID 133064447
1-[(3R,4S)-3-[[dimethyl(phenyl)silyl]methyl]-4-methylpyrrolidin-1-yl]ethanone
CID 10612466
N-[1-[dimethyl(phenyl)silyl]propyl]acetamide
CID 11075395
(Z)-N-methyl-3-phenylselanyl-N-prop-2-enylhex-2-enamide
CID 11255717
(Z)-N,N-dimethyl-3-phenylselanylhex-2-enamide
CID 12121919
6-[dimethyl(phenyl)silyl]-N,N-diethylhept-6-enamide
CID 86003269
1-[dimethyl(phenyl)silyl]-N,N-dimethylformamide
CID 102383726
N-methyl-N-[chloro(methyl)phenylsilylmethyl)acetamide
CID 129768234
N-[chloro(phenyl)silyl]methyl-N-methylacet-amide
CID 133064931
N,N-diethyl-3-phenylselanylprop-2-enamide
CID 134963903
(E)-7-[dimethyl(phenyl)silyl]-N,N-diethylhept-6-enamide
CID 134999553
(E)-3-[dimethyl(phenyl)silyl]-N,N-dimethyl-3-tributylstannylhex-4-enamide
CID 135005470

Frequently Asked Questions

What is the IUPAC name of (E)-3-[dimethyl(phenyl)silyl]-N,N-diethylhept-2-enamide?
The IUPAC name of (E)-3-[dimethyl(phenyl)silyl]-N,N-diethylhept-2-enamide (CID 134950259) is (E)-3-[dimethyl(phenyl)silyl]-N,N-diethylhept-2-enamide.
What is the SMILES notation for (E)-3-[dimethyl(phenyl)silyl]-N,N-diethylhept-2-enamide?
The canonical SMILES for (E)-3-[dimethyl(phenyl)silyl]-N,N-diethylhept-2-enamide is CCCC/C(=C\C(=O)N(CC)CC)[Si](C)(C)c1ccccc1.
What is the InChIKey of (E)-3-[dimethyl(phenyl)silyl]-N,N-diethylhept-2-enamide?
The InChIKey is DRQQJDSVTUJDKV-FBMGVBCBSA-N. The full InChI is InChI=1S/C19H31NOSi/c1-6-9-13-18(16-19(21)20(7-2)8-3)22(4,5)17-14-11-10-12-15-17/h10-12,14-16H,6-9,13H2,1-5H3/b18-16+.
What are the key properties of (E)-3-[dimethyl(phenyl)silyl]-N,N-diethylhept-2-enamide?
(E)-3-[dimethyl(phenyl)silyl]-N,N-diethylhept-2-enamide has a molecular weight of 317.55 g/mol, XLogP of 4.13, 8 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for (E)-3-[dimethyl(phenyl)silyl]-N,N-diethylhept-2-enamide is sourced from PubChem (CID 134950259), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).