methyl N-[(2R)-5-trimethylsilylpent-4-yn-2-yl]carbamate

C10H19NO2Si — CID 11063776

IUPACmethyl N-[(2R)-5-trimethylsilylpent-4-yn-2-yl]carbamate
SMILESCOC(=O)N[C@H](C)CC#C[Si](C)(C)C
InChIInChI=1S/C10H19NO2Si/c1-9(11-10(12)13-2)7-6-8-14(3,4)5/h9H,7H2,1-5H3,(H,11,12)/t9-/m1/s1
InChIKeyPFGLYRUOUBQCRG-SECBINFHSA-N
MW213.35 g/mol
LogP2.00
Rot. Bonds2

About methyl N-[(2R)-5-trimethylsilylpent-4-yn-2-yl]carbamate

methyl N-[(2R)-5-trimethylsilylpent-4-yn-2-yl]carbamate (PubChem CID 11063776) has the molecular formula C10H19NO2Si and a molecular weight of 213.35 g/mol. Its IUPAC name is methyl N-[(2R)-5-trimethylsilylpent-4-yn-2-yl]carbamate.

Molecular Properties

Compound Namemethyl N-[(2R)-5-trimethylsilylpent-4-yn-2-yl]carbamate
PubChem CID11063776
Molecular FormulaC10H19NO2Si
Molecular Weight213.35 g/mol
Exact Mass213.12
IUPAC Namemethyl N-[(2R)-5-trimethylsilylpent-4-yn-2-yl]carbamate
SMILESCOC(=O)N[C@H](C)CC#C[Si](C)(C)C
InChIInChI=1S/C10H19NO2Si/c1-9(11-10(12)13-2)7-6-8-14(3,4)5/h9H,7H2,1-5H3,(H,11,12)/t9-/m1/s1
InChIKeyPFGLYRUOUBQCRG-SECBINFHSA-N
XLogP2.00
TPSA38.33 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500213.35
LogP ≤ 52.00
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

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

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Related Compounds

tert-butyl N-[(2R)-hex-4-yn-2-yl]carbamate
CID 163670253
methyl N-(4-methylpentan-2-yl)carbamate
CID 88914319
[(2R)-5-trimethylsilylpent-4-yn-2-yl] carbamate
CID 175398792
(4S)-1-dimethoxyphosphoryl-4-methyl-7-trimethylsilylhept-6-yn-2-one
CID 23636318
methyl N-(4-methoxy-4-methylpentan-2-yl)carbamate
CID 173238206
5-trimethylsilylpent-4-yn-2-one
CID 12685334
(2R)-2-hydroxy-5-trimethylsilylpent-4-ynal
CID 89079207
tert-butyl N-(3-trimethylsilylprop-2-ynoxy)carbamate
CID 11276581
methyl (3S)-3-propan-2-yl-5-trimethylsilylpent-4-ynoate
CID 10868013
methyl (E)-3-methyl-6-trimethylsilylhex-2-en-5-ynoate
CID 11805971
methyl N-(1-fluoroethyl)carbamate
CID 166647333
methyl N-(3-methylbutan-2-yl)carbamate
CID 3614647

Frequently Asked Questions

What is the IUPAC name of methyl N-[(2R)-5-trimethylsilylpent-4-yn-2-yl]carbamate?
The IUPAC name of methyl N-[(2R)-5-trimethylsilylpent-4-yn-2-yl]carbamate (CID 11063776) is methyl N-[(2R)-5-trimethylsilylpent-4-yn-2-yl]carbamate.
What is the SMILES notation for methyl N-[(2R)-5-trimethylsilylpent-4-yn-2-yl]carbamate?
The canonical SMILES for methyl N-[(2R)-5-trimethylsilylpent-4-yn-2-yl]carbamate is COC(=O)N[C@H](C)CC#C[Si](C)(C)C.
What is the InChIKey of methyl N-[(2R)-5-trimethylsilylpent-4-yn-2-yl]carbamate?
The InChIKey is PFGLYRUOUBQCRG-SECBINFHSA-N. The full InChI is InChI=1S/C10H19NO2Si/c1-9(11-10(12)13-2)7-6-8-14(3,4)5/h9H,7H2,1-5H3,(H,11,12)/t9-/m1/s1.
What are the key properties of methyl N-[(2R)-5-trimethylsilylpent-4-yn-2-yl]carbamate?
methyl N-[(2R)-5-trimethylsilylpent-4-yn-2-yl]carbamate has a molecular weight of 213.35 g/mol, XLogP of 2.00, 2 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for methyl N-[(2R)-5-trimethylsilylpent-4-yn-2-yl]carbamate is sourced from PubChem (CID 11063776), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).