4-(hydroxymethyl)-N-(trimethylsilylmethyl)benzamide

C12H19NO2Si — CID 174748674

IUPAC4-(hydroxymethyl)-N-(trimethylsilylmethyl)benzamide
SMILESC[Si](C)(C)CNC(=O)c1ccc(CO)cc1
InChIInChI=1S/C12H19NO2Si/c1-16(2,3)9-13-12(15)11-6-4-10(8-14)5-7-11/h4-7,14H,8-9H2,1-3H3,(H,13,15)
InChIKeyNNIRNOSQWDMPOS-UHFFFAOYSA-N
MW237.38 g/mol
LogP1.79
Rot. Bonds4

About 4-(hydroxymethyl)-N-(trimethylsilylmethyl)benzamide

4-(hydroxymethyl)-N-(trimethylsilylmethyl)benzamide (PubChem CID 174748674) has the molecular formula C12H19NO2Si and a molecular weight of 237.38 g/mol. Its IUPAC name is 4-(hydroxymethyl)-N-(trimethylsilylmethyl)benzamide.

Molecular Properties

Compound Name4-(hydroxymethyl)-N-(trimethylsilylmethyl)benzamide
PubChem CID174748674
Molecular FormulaC12H19NO2Si
Molecular Weight237.38 g/mol
Exact Mass237.12
IUPAC Name4-(hydroxymethyl)-N-(trimethylsilylmethyl)benzamide
SMILESC[Si](C)(C)CNC(=O)c1ccc(CO)cc1
InChIInChI=1S/C12H19NO2Si/c1-16(2,3)9-13-12(15)11-6-4-10(8-14)5-7-11/h4-7,14H,8-9H2,1-3H3,(H,13,15)
InChIKeyNNIRNOSQWDMPOS-UHFFFAOYSA-N
XLogP1.79
TPSA49.33 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500237.38
LogP ≤ 51.79
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

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

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Related Compounds

acetic acid;N-(2-aminoethyl)-4-(hydroxymethyl)benzamide
CID 67918850
N-(3-hydroxypropyl)-4-(trimethylsilylmethylamino)benzamide
CID 111778041
N-benzyl-4-(hydroxymethyl)benzamide
CID 4125778
4-(hydroxymethyl)-N-(5-hydroxy-4-methylpentyl)benzamide
CID 106155019
4-(aminomethyl)-N-[[4-(hydroxymethyl)phenyl]methyl]benzamide
CID 107229542
4-(chloromethyl)-N-[[4-(hydroxymethyl)phenyl]methyl]benzamide
CID 107230293
2-trimethylsilylethyl 4-(hydroxymethyl)benzoate
CID 178078646
4-(hydroxymethyl)-N-[2-(1H-imidazol-5-yl)ethyl]benzamide
CID 65231177
4-(hydroxymethyl)-N-[2-(4-propan-2-yloxyphenyl)ethyl]benzamide
CID 126821115
4-(hydroxymethyl)-N-[(3-methylphenyl)methyl]benzamide
CID 134067704
4-(hydroxymethyl)-N-[[4-[(3-hydroxypropylcarbamoylamino)methyl]phenyl]methyl]benzamide
CID 102124965
4-(hydroxymethyl)-N-[[1-(hydroxymethyl)cyclopropyl]methyl]benzamide
CID 113313378

Frequently Asked Questions

What is the IUPAC name of 4-(hydroxymethyl)-N-(trimethylsilylmethyl)benzamide?
The IUPAC name of 4-(hydroxymethyl)-N-(trimethylsilylmethyl)benzamide (CID 174748674) is 4-(hydroxymethyl)-N-(trimethylsilylmethyl)benzamide.
What is the SMILES notation for 4-(hydroxymethyl)-N-(trimethylsilylmethyl)benzamide?
The canonical SMILES for 4-(hydroxymethyl)-N-(trimethylsilylmethyl)benzamide is C[Si](C)(C)CNC(=O)c1ccc(CO)cc1.
What is the InChIKey of 4-(hydroxymethyl)-N-(trimethylsilylmethyl)benzamide?
The InChIKey is NNIRNOSQWDMPOS-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H19NO2Si/c1-16(2,3)9-13-12(15)11-6-4-10(8-14)5-7-11/h4-7,14H,8-9H2,1-3H3,(H,13,15).
What are the key properties of 4-(hydroxymethyl)-N-(trimethylsilylmethyl)benzamide?
4-(hydroxymethyl)-N-(trimethylsilylmethyl)benzamide has a molecular weight of 237.38 g/mol, XLogP of 1.79, 4 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 4-(hydroxymethyl)-N-(trimethylsilylmethyl)benzamide is sourced from PubChem (CID 174748674), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).