[(R)-cyclohexen-1-yl(trimethylsilyl)methyl] N,N-di(propan-2-yl)carbamate

C17H33NO2Si — CID 10892321

IUPAC[(R)-cyclohexen-1-yl(trimethylsilyl)methyl] N,N-di(propan-2-yl)carbamate
SMILESCC(C)N(C(=O)O[C@@H](C1=CCCCC1)[Si](C)(C)C)C(C)C
InChIInChI=1S/C17H33NO2Si/c1-13(2)18(14(3)4)17(19)20-16(21(5,6)7)15-11-9-8-10-12-15/h11,13-14,16H,8-10,12H2,1-7H3/t16-/m1/s1
InChIKeyDMLODPAZOALREF-MRXNPFEDSA-N
MW311.54 g/mol
LogP4.99
Rot. Bonds5

About [(R)-cyclohexen-1-yl(trimethylsilyl)methyl] N,N-di(propan-2-yl)carbamate

[(R)-cyclohexen-1-yl(trimethylsilyl)methyl] N,N-di(propan-2-yl)carbamate (PubChem CID 10892321) has the molecular formula C17H33NO2Si and a molecular weight of 311.54 g/mol. Its IUPAC name is [(R)-cyclohexen-1-yl(trimethylsilyl)methyl] N,N-di(propan-2-yl)carbamate.

Molecular Properties

Compound Name[(R)-cyclohexen-1-yl(trimethylsilyl)methyl] N,N-di(propan-2-yl)carbamate
PubChem CID10892321
Molecular FormulaC17H33NO2Si
Molecular Weight311.54 g/mol
Exact Mass311.23
IUPAC Name[(R)-cyclohexen-1-yl(trimethylsilyl)methyl] N,N-di(propan-2-yl)carbamate
SMILESCC(C)N(C(=O)O[C@@H](C1=CCCCC1)[Si](C)(C)C)C(C)C
InChIInChI=1S/C17H33NO2Si/c1-13(2)18(14(3)4)17(19)20-16(21(5,6)7)15-11-9-8-10-12-15/h11,13-14,16H,8-10,12H2,1-7H3/t16-/m1/s1
InChIKeyDMLODPAZOALREF-MRXNPFEDSA-N
XLogP4.99
TPSA29.54 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds5
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500311.54
LogP ≤ 54.99
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

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

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Related Compounds

[(R)-[(1E)-2-methylcycloocten-1-yl]-trimethylsilylmethyl] N,N-di(propan-2-yl)carbamate
CID 102020945
lithium cyclohexen-1-ylmethyl N,N-di(propan-2-yl)carbamate
CID 177495934
[(S)-1,4-dioxaspiro[4.4]non-8-en-9-yl(trimethylsilyl)methyl] N,N-di(propan-2-yl)carbamate
CID 10861187
1-(cyclohexen-1-yl)ethyl methyl carbonate
CID 102371125
[(R)-(2-methylcyclohexen-1-yl)-[methyl(diphenyl)silyl]methyl] N,N-di(propan-2-yl)carbamate
CID 11733064
3-(cycloocten-1-yl)butanoic acid
CID 154246117
diethyl 2-[(1R)-1-(cyclohexen-1-yl)ethyl]propanedioate
CID 11129313
[(2-methylcyclohexen-1-yl)-trimethylstannylmethyl] N,N-di(propan-2-yl)carbamate
CID 11761505
ethyl 2-[(1E)-cyclododecen-1-yl]-2-hydroxyacetate
CID 165457413
ethyl 2-(cyclohepten-1-yl)propanoate
CID 15353402
ethyl 2-[(1E)-cyclodecen-1-yl]propanoate
CID 15353405
ethyl 2-(cyclododecen-1-yl)propanoate
CID 57035955

Frequently Asked Questions

What is the IUPAC name of [(R)-cyclohexen-1-yl(trimethylsilyl)methyl] N,N-di(propan-2-yl)carbamate?
The IUPAC name of [(R)-cyclohexen-1-yl(trimethylsilyl)methyl] N,N-di(propan-2-yl)carbamate (CID 10892321) is [(R)-cyclohexen-1-yl(trimethylsilyl)methyl] N,N-di(propan-2-yl)carbamate.
What is the SMILES notation for [(R)-cyclohexen-1-yl(trimethylsilyl)methyl] N,N-di(propan-2-yl)carbamate?
The canonical SMILES for [(R)-cyclohexen-1-yl(trimethylsilyl)methyl] N,N-di(propan-2-yl)carbamate is CC(C)N(C(=O)O[C@@H](C1=CCCCC1)[Si](C)(C)C)C(C)C.
What is the InChIKey of [(R)-cyclohexen-1-yl(trimethylsilyl)methyl] N,N-di(propan-2-yl)carbamate?
The InChIKey is DMLODPAZOALREF-MRXNPFEDSA-N. The full InChI is InChI=1S/C17H33NO2Si/c1-13(2)18(14(3)4)17(19)20-16(21(5,6)7)15-11-9-8-10-12-15/h11,13-14,16H,8-10,12H2,1-7H3/t16-/m1/s1.
What are the key properties of [(R)-cyclohexen-1-yl(trimethylsilyl)methyl] N,N-di(propan-2-yl)carbamate?
[(R)-cyclohexen-1-yl(trimethylsilyl)methyl] N,N-di(propan-2-yl)carbamate has a molecular weight of 311.54 g/mol, XLogP of 4.99, 5 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for [(R)-cyclohexen-1-yl(trimethylsilyl)methyl] N,N-di(propan-2-yl)carbamate is sourced from PubChem (CID 10892321), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).