N-cyclopenta-1,3-dien-1-yl-N,2,2,3-tetramethyl-3-[methyl(phenyl)silyl]butanamide

C20H29NOSi — CID 123827323

IUPACN-cyclopenta-1,3-dien-1-yl-N,2,2,3-tetramethyl-3-[methyl(phenyl)silyl]butanamide
SMILESCN(C(=O)C(C)(C)C(C)(C)[SiH](C)c1ccccc1)C1=CC=CC1
InChIInChI=1S/C20H29NOSi/c1-19(2,18(22)21(5)16-12-10-11-13-16)20(3,4)23(6)17-14-8-7-9-15-17/h7-12,14-15,23H,13H2,1-6H3
InChIKeyMIFTYPCBFCFPPY-UHFFFAOYSA-N
MW327.54 g/mol
LogP3.86
Rot. Bonds5

About N-cyclopenta-1,3-dien-1-yl-N,2,2,3-tetramethyl-3-[methyl(phenyl)silyl]butanamide

N-cyclopenta-1,3-dien-1-yl-N,2,2,3-tetramethyl-3-[methyl(phenyl)silyl]butanamide (PubChem CID 123827323) has the molecular formula C20H29NOSi and a molecular weight of 327.54 g/mol. Its IUPAC name is N-cyclopenta-1,3-dien-1-yl-N,2,2,3-tetramethyl-3-[methyl(phenyl)silyl]butanamide.

Molecular Properties

Compound NameN-cyclopenta-1,3-dien-1-yl-N,2,2,3-tetramethyl-3-[methyl(phenyl)silyl]butanamide
PubChem CID123827323
Molecular FormulaC20H29NOSi
Molecular Weight327.54 g/mol
Exact Mass327.20
IUPAC NameN-cyclopenta-1,3-dien-1-yl-N,2,2,3-tetramethyl-3-[methyl(phenyl)silyl]butanamide
SMILESCN(C(=O)C(C)(C)C(C)(C)[SiH](C)c1ccccc1)C1=CC=CC1
InChIInChI=1S/C20H29NOSi/c1-19(2,18(22)21(5)16-12-10-11-13-16)20(3,4)23(6)17-14-8-7-9-15-17/h7-12,14-15,23H,13H2,1-6H3
InChIKeyMIFTYPCBFCFPPY-UHFFFAOYSA-N
XLogP3.86
TPSA20.31 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds5
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500327.54
LogP ≤ 53.86
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

Computed Properties (RDKit)

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

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Related Compounds

1-[(3R,4S)-3-[[dimethyl(phenyl)silyl]methyl]-4-methylpyrrolidin-1-yl]ethanone
CID 10612466
(E)-6-(dimethylamino)-6-[dimethyl(phenyl)silyl]-N,N,3,3,4,4-hexamethylhex-5-enamide
CID 12104180
N-[1-[dimethyl(phenyl)silyl]propyl]-N,2-dimethylbutanamide
CID 15399366

Frequently Asked Questions

What is the IUPAC name of N-cyclopenta-1,3-dien-1-yl-N,2,2,3-tetramethyl-3-[methyl(phenyl)silyl]butanamide?
The IUPAC name of N-cyclopenta-1,3-dien-1-yl-N,2,2,3-tetramethyl-3-[methyl(phenyl)silyl]butanamide (CID 123827323) is N-cyclopenta-1,3-dien-1-yl-N,2,2,3-tetramethyl-3-[methyl(phenyl)silyl]butanamide.
What is the SMILES notation for N-cyclopenta-1,3-dien-1-yl-N,2,2,3-tetramethyl-3-[methyl(phenyl)silyl]butanamide?
The canonical SMILES for N-cyclopenta-1,3-dien-1-yl-N,2,2,3-tetramethyl-3-[methyl(phenyl)silyl]butanamide is CN(C(=O)C(C)(C)C(C)(C)[SiH](C)c1ccccc1)C1=CC=CC1.
What is the InChIKey of N-cyclopenta-1,3-dien-1-yl-N,2,2,3-tetramethyl-3-[methyl(phenyl)silyl]butanamide?
The InChIKey is MIFTYPCBFCFPPY-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H29NOSi/c1-19(2,18(22)21(5)16-12-10-11-13-16)20(3,4)23(6)17-14-8-7-9-15-17/h7-12,14-15,23H,13H2,1-6H3.
What are the key properties of N-cyclopenta-1,3-dien-1-yl-N,2,2,3-tetramethyl-3-[methyl(phenyl)silyl]butanamide?
N-cyclopenta-1,3-dien-1-yl-N,2,2,3-tetramethyl-3-[methyl(phenyl)silyl]butanamide has a molecular weight of 327.54 g/mol, XLogP of 3.86, 5 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for N-cyclopenta-1,3-dien-1-yl-N,2,2,3-tetramethyl-3-[methyl(phenyl)silyl]butanamide is sourced from PubChem (CID 123827323), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).