N-(3-butyl-3-trimethylsilylheptyl)-N,2-dimethylprop-2-enamide

C19H39NOSi — CID 59819360

IUPACN-(3-butyl-3-trimethylsilylheptyl)-N,2-dimethylprop-2-enamide
SMILESC=C(C)C(=O)N(C)CCC(CCCC)(CCCC)[Si](C)(C)C
InChIInChI=1S/C19H39NOSi/c1-9-11-13-19(14-12-10-2,22(6,7)8)15-16-20(5)18(21)17(3)4/h3,9-16H2,1-2,4-8H3
InChIKeyWSOUMYTYFOHCCK-UHFFFAOYSA-N
MW325.61 g/mol
LogP5.87
Rot. Bonds11

About N-(3-butyl-3-trimethylsilylheptyl)-N,2-dimethylprop-2-enamide

N-(3-butyl-3-trimethylsilylheptyl)-N,2-dimethylprop-2-enamide (PubChem CID 59819360) has the molecular formula C19H39NOSi and a molecular weight of 325.61 g/mol. Its IUPAC name is N-(3-butyl-3-trimethylsilylheptyl)-N,2-dimethylprop-2-enamide.

Molecular Properties

Compound NameN-(3-butyl-3-trimethylsilylheptyl)-N,2-dimethylprop-2-enamide
PubChem CID59819360
Molecular FormulaC19H39NOSi
Molecular Weight325.61 g/mol
Exact Mass325.28
IUPAC NameN-(3-butyl-3-trimethylsilylheptyl)-N,2-dimethylprop-2-enamide
SMILESC=C(C)C(=O)N(C)CCC(CCCC)(CCCC)[Si](C)(C)C
InChIInChI=1S/C19H39NOSi/c1-9-11-13-19(14-12-10-2,22(6,7)8)15-16-20(5)18(21)17(3)4/h3,9-16H2,1-2,4-8H3
InChIKeyWSOUMYTYFOHCCK-UHFFFAOYSA-N
XLogP5.87
TPSA20.31 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds11
Heavy Atoms22
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500325.61
LogP ≤ 55.87
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,2-dimethyl-N-tetracosylprop-2-enamide
CID 87262023
N',N'-dibutyl-N,2-dimethylprop-2-enehydrazide
CID 87504496
N-(4-amino-4-methylpentyl)-N,2-dimethylprop-2-enamide
CID 138739134
N-[3-[diethoxy(methyl)silyl]propyl]-N,2-dimethylprop-2-enamide
CID 139724660
N-(iodomethyl)-N,2-dimethylprop-2-enamide
CID 146497620
N,2-dimethyl-N-[3-[4-(4-pentylphenyl)phenyl]propyl]prop-2-enamide
CID 134246359
2-methyl-N-pentylprop-2-enehydrazide
CID 87197020
N-butyl-2-methyl-N-pentylprop-2-enamide
CID 87098831
2-[[methyl(2-methylprop-2-enoyl)amino]methyl]hexanoic acid
CID 91186254
N-butyl-N-methyl-2-oxopropanamide;ethane
CID 142836775
N,2-dimethyl-N-[2-[methyl(prop-2-enoyl)amino]ethyl]prop-2-enamide
CID 23525820
N-butyl-2-methyl-N-octylprop-2-enamide
CID 20743986

Frequently Asked Questions

What is the IUPAC name of N-(3-butyl-3-trimethylsilylheptyl)-N,2-dimethylprop-2-enamide?
The IUPAC name of N-(3-butyl-3-trimethylsilylheptyl)-N,2-dimethylprop-2-enamide (CID 59819360) is N-(3-butyl-3-trimethylsilylheptyl)-N,2-dimethylprop-2-enamide.
What is the SMILES notation for N-(3-butyl-3-trimethylsilylheptyl)-N,2-dimethylprop-2-enamide?
The canonical SMILES for N-(3-butyl-3-trimethylsilylheptyl)-N,2-dimethylprop-2-enamide is C=C(C)C(=O)N(C)CCC(CCCC)(CCCC)[Si](C)(C)C.
What is the InChIKey of N-(3-butyl-3-trimethylsilylheptyl)-N,2-dimethylprop-2-enamide?
The InChIKey is WSOUMYTYFOHCCK-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H39NOSi/c1-9-11-13-19(14-12-10-2,22(6,7)8)15-16-20(5)18(21)17(3)4/h3,9-16H2,1-2,4-8H3.
What are the key properties of N-(3-butyl-3-trimethylsilylheptyl)-N,2-dimethylprop-2-enamide?
N-(3-butyl-3-trimethylsilylheptyl)-N,2-dimethylprop-2-enamide has a molecular weight of 325.61 g/mol, XLogP of 5.87, 11 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for N-(3-butyl-3-trimethylsilylheptyl)-N,2-dimethylprop-2-enamide is sourced from PubChem (CID 59819360), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).