silyl N-propylcarbamate

C4H11NO2Si — CID 174599243

IUPACsilyl N-propylcarbamate
SMILESCCCNC(=O)O[SiH3]
InChIInChI=1S/C4H11NO2Si/c1-2-3-5-4(6)7-8/h2-3H2,1,8H3,(H,5,6)
InChIKeyCCDWSQKAGWHTKH-UHFFFAOYSA-N
MW133.22 g/mol
LogP-0.60
Rot. Bonds2

About silyl N-propylcarbamate

silyl N-propylcarbamate (PubChem CID 174599243) has the molecular formula C4H11NO2Si and a molecular weight of 133.22 g/mol. Its IUPAC name is silyl N-propylcarbamate.

Molecular Properties

Compound Namesilyl N-propylcarbamate
PubChem CID174599243
Molecular FormulaC4H11NO2Si
Molecular Weight133.22 g/mol
Exact Mass133.06
IUPAC Namesilyl N-propylcarbamate
SMILESCCCNC(=O)O[SiH3]
InChIInChI=1S/C4H11NO2Si/c1-2-3-5-4(6)7-8/h2-3H2,1,8H3,(H,5,6)
InChIKeyCCDWSQKAGWHTKH-UHFFFAOYSA-N
XLogP-0.60
TPSA38.33 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms8
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500133.22
LogP ≤ 5-0.60
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

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

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Related Compounds

ethyl N-propylcarbamate
CID 12199
methylsulfanyl N-propylcarbamate
CID 154454730
dihydroxymethyl N-propylcarbamate
CID 174469308
2-hydroxyethyl N-propylcarbamate
CID 15560805
methyl (2S)-2,3,3-trimethyl-2-(propylcarbamoyloxy)butanoate
CID 86303559
[2-methyl-3-(propylcarbamoyloxy)-2-(propylcarbamoyloxymethyl)propyl] N-propylcarbamate
CID 126540668
octadecyl N-propylcarbamate
CID 175015942
methyl N-[4-oxo-4-(propylamino)but-2-enoyl]carbamate
CID 58159323
(1,1,1-trichloro-2-methylpropan-2-yl) N-propylcarbamate
CID 159172104
2-methoxy-N-propylprop-2-enamide
CID 55287359
methyl N-nonylcarbamate
CID 5102101
3-(propylamino)propyl N-propylcarbamate
CID 166733433

Frequently Asked Questions

What is the IUPAC name of silyl N-propylcarbamate?
The IUPAC name of silyl N-propylcarbamate (CID 174599243) is silyl N-propylcarbamate.
What is the SMILES notation for silyl N-propylcarbamate?
The canonical SMILES for silyl N-propylcarbamate is CCCNC(=O)O[SiH3].
What is the InChIKey of silyl N-propylcarbamate?
The InChIKey is CCDWSQKAGWHTKH-UHFFFAOYSA-N. The full InChI is InChI=1S/C4H11NO2Si/c1-2-3-5-4(6)7-8/h2-3H2,1,8H3,(H,5,6).
What are the key properties of silyl N-propylcarbamate?
silyl N-propylcarbamate has a molecular weight of 133.22 g/mol, XLogP of -0.60, 2 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for silyl N-propylcarbamate is sourced from PubChem (CID 174599243), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).