N-[[chloro-bis(trimethylsilyl)silyl]methyl]-N-(2-methylphenyl)acetamide

C16H30ClNOSi3 — CID 139926884

IUPACN-[[chloro-bis(trimethylsilyl)silyl]methyl]-N-(2-methylphenyl)acetamide
SMILESCC(=O)N(C[Si](Cl)([Si](C)(C)C)[Si](C)(C)C)c1ccccc1C
InChIInChI=1S/C16H30ClNOSi3/c1-14-11-9-10-12-16(14)18(15(2)19)13-22(17,20(3,4)5)21(6,7)8/h9-12H,13H2,1-8H3
InChIKeyRMQSBKZGELUJGM-UHFFFAOYSA-N
MW372.13 g/mol
LogP4.90
Rot. Bonds5

About N-[[chloro-bis(trimethylsilyl)silyl]methyl]-N-(2-methylphenyl)acetamide

N-[[chloro-bis(trimethylsilyl)silyl]methyl]-N-(2-methylphenyl)acetamide (PubChem CID 139926884) has the molecular formula C16H30ClNOSi3 and a molecular weight of 372.13 g/mol. Its IUPAC name is N-[[chloro-bis(trimethylsilyl)silyl]methyl]-N-(2-methylphenyl)acetamide.

Molecular Properties

Compound NameN-[[chloro-bis(trimethylsilyl)silyl]methyl]-N-(2-methylphenyl)acetamide
PubChem CID139926884
Molecular FormulaC16H30ClNOSi3
Molecular Weight372.13 g/mol
Exact Mass371.13
IUPAC NameN-[[chloro-bis(trimethylsilyl)silyl]methyl]-N-(2-methylphenyl)acetamide
SMILESCC(=O)N(C[Si](Cl)([Si](C)(C)C)[Si](C)(C)C)c1ccccc1C
InChIInChI=1S/C16H30ClNOSi3/c1-14-11-9-10-12-16(14)18(15(2)19)13-22(17,20(3,4)5)21(6,7)8/h9-12H,13H2,1-8H3
InChIKeyRMQSBKZGELUJGM-UHFFFAOYSA-N
XLogP4.90
TPSA20.31 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds5
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500372.13
LogP ≤ 54.90
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

Computed Properties (RDKit)

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

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Related Compounds

N-(4-chloro-3-oxobutyl)-N-(2-methylphenyl)acetamide
CID 104700970
methyl 2-(N-acetyl-2-methylanilino)acetate
CID 20717630
N-(2-methylphenyl)-N-(propan-2-yloxymethyl)acetamide
CID 66617334
methyl 3-(N-acetyl-2-methylanilino)propanoate
CID 75507009
3-(N-acetyl-2-methylanilino)-N,N-dipropylpropanamide
CID 113123613
N-[2-(methanesulfonamido)ethyl]-N-(2-methylphenyl)acetamide
CID 113057355
2-(N-acetyl-2-methylanilino)-N-butyl-N-methylacetamide
CID 113167338
3-(N-acetyl-2-methylanilino)-N-(2-methylphenyl)propanamide
CID 113123619
2,2-dichloro-N-ethyl-N-(2-methylphenyl)acetamide
CID 3338024
2-(N-acetyl-2-methylanilino)-N-[(2-chlorophenyl)methyl]acetamide
CID 113167289
2-chloro-N-ethyl-N-(2-methylphenyl)furan-3-carboxamide
CID 106685239
ethyl N-[2-(N-acetyl-2-methylanilino)ethyl]carbamate
CID 113057346

Frequently Asked Questions

What is the IUPAC name of N-[[chloro-bis(trimethylsilyl)silyl]methyl]-N-(2-methylphenyl)acetamide?
The IUPAC name of N-[[chloro-bis(trimethylsilyl)silyl]methyl]-N-(2-methylphenyl)acetamide (CID 139926884) is N-[[chloro-bis(trimethylsilyl)silyl]methyl]-N-(2-methylphenyl)acetamide.
What is the SMILES notation for N-[[chloro-bis(trimethylsilyl)silyl]methyl]-N-(2-methylphenyl)acetamide?
The canonical SMILES for N-[[chloro-bis(trimethylsilyl)silyl]methyl]-N-(2-methylphenyl)acetamide is CC(=O)N(C[Si](Cl)([Si](C)(C)C)[Si](C)(C)C)c1ccccc1C.
What is the InChIKey of N-[[chloro-bis(trimethylsilyl)silyl]methyl]-N-(2-methylphenyl)acetamide?
The InChIKey is RMQSBKZGELUJGM-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H30ClNOSi3/c1-14-11-9-10-12-16(14)18(15(2)19)13-22(17,20(3,4)5)21(6,7)8/h9-12H,13H2,1-8H3.
What are the key properties of N-[[chloro-bis(trimethylsilyl)silyl]methyl]-N-(2-methylphenyl)acetamide?
N-[[chloro-bis(trimethylsilyl)silyl]methyl]-N-(2-methylphenyl)acetamide has a molecular weight of 372.13 g/mol, XLogP of 4.90, 5 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for N-[[chloro-bis(trimethylsilyl)silyl]methyl]-N-(2-methylphenyl)acetamide is sourced from PubChem (CID 139926884), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).