[(Z)-4-trimethylstannylpent-2-en-2-yl] N,N-di(propan-2-yl)carbamate

C15H31NO2Sn — CID 14492456

IUPAC[(Z)-4-trimethylstannylpent-2-en-2-yl] N,N-di(propan-2-yl)carbamate
SMILESC/C(=C/C(C)[Sn](C)(C)C)OC(=O)N(C(C)C)C(C)C
InChIInChI=1S/C12H22NO2.3CH3.Sn/c1-7-8-11(6)15-12(14)13(9(2)3)10(4)5;;;;/h7-10H,1-6H3;3*1H3;/b11-8-;;;;
InChIKeyXZRMUAVNPSKDFK-KNBWSUOLSA-N
MW376.13 g/mol
LogP4.87
Rot. Bonds5

About [(Z)-4-trimethylstannylpent-2-en-2-yl] N,N-di(propan-2-yl)carbamate

[(Z)-4-trimethylstannylpent-2-en-2-yl] N,N-di(propan-2-yl)carbamate (PubChem CID 14492456) has the molecular formula C15H31NO2Sn and a molecular weight of 376.13 g/mol. Its IUPAC name is [(Z)-4-trimethylstannylpent-2-en-2-yl] N,N-di(propan-2-yl)carbamate.

Molecular Properties

Compound Name[(Z)-4-trimethylstannylpent-2-en-2-yl] N,N-di(propan-2-yl)carbamate
PubChem CID14492456
Molecular FormulaC15H31NO2Sn
Molecular Weight376.13 g/mol
Exact Mass377.14
IUPAC Name[(Z)-4-trimethylstannylpent-2-en-2-yl] N,N-di(propan-2-yl)carbamate
SMILESC/C(=C/C(C)[Sn](C)(C)C)OC(=O)N(C(C)C)C(C)C
InChIInChI=1S/C12H22NO2.3CH3.Sn/c1-7-8-11(6)15-12(14)13(9(2)3)10(4)5;;;;/h7-10H,1-6H3;3*1H3;/b11-8-;;;;
InChIKeyXZRMUAVNPSKDFK-KNBWSUOLSA-N
XLogP4.87
TPSA29.54 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds5
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500376.13
LogP ≤ 54.87
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'acyclic_C=C-O', 'substructure': 'N/A'}

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Related Compounds

[(Z)-1-[(1S)-2,2-dimethylcyclopropyl]prop-1-en-2-yl] N,N-di(propan-2-yl)carbamate
CID 101381446
[(3E)-penta-1,3-dien-3-yl] N,N-di(propan-2-yl)carbamate
CID 15727159
[(E)-2-[(1S)-2,2-dimethylcyclopropyl]-1-trimethylstannylethenyl] N,N-di(propan-2-yl)carbamate
CID 177428027
[(Z,4S,5R)-5-hydroxy-4-(2-phenylmethoxyethyl)hept-2-en-2-yl] N,N-di(propan-2-yl)carbamate
CID 102213264
[(4Z)-7-hydroxy-2,6,8,8-tetramethylnona-2,4-dien-4-yl] N,N-di(propan-2-yl)carbamate
CID 23631775
[(Z,3S,4R)-4-hydroxy-3-methyl-1-trimethylsilylhept-1-enyl] N,N-di(propan-2-yl)carbamate
CID 101343519
[(2S)-but-3-en-2-yl] N,N-di(propan-2-yl)carbamate
CID 12901919
(Z,2R)-2,3-dimethyl-N,N-di(propan-2-yl)pent-3-enamide
CID 14921251
(Z,2S)-2,3-dimethyl-N,N-di(propan-2-yl)pent-3-enamide
CID 101053961
[(Z)-1-trimethylsilylbut-2-enyl] N,N-di(propan-2-yl)carbamate
CID 13329873
[(Z)-3-phenyl-1-trimethylsilylprop-1-enyl] N,N-di(propan-2-yl)carbamate
CID 101343522
2-cyclohexylprop-1-enyl N,N-di(propan-2-yl)carbamate
CID 71378000

Frequently Asked Questions

What is the IUPAC name of [(Z)-4-trimethylstannylpent-2-en-2-yl] N,N-di(propan-2-yl)carbamate?
The IUPAC name of [(Z)-4-trimethylstannylpent-2-en-2-yl] N,N-di(propan-2-yl)carbamate (CID 14492456) is [(Z)-4-trimethylstannylpent-2-en-2-yl] N,N-di(propan-2-yl)carbamate.
What is the SMILES notation for [(Z)-4-trimethylstannylpent-2-en-2-yl] N,N-di(propan-2-yl)carbamate?
The canonical SMILES for [(Z)-4-trimethylstannylpent-2-en-2-yl] N,N-di(propan-2-yl)carbamate is C/C(=C/C(C)[Sn](C)(C)C)OC(=O)N(C(C)C)C(C)C.
What is the InChIKey of [(Z)-4-trimethylstannylpent-2-en-2-yl] N,N-di(propan-2-yl)carbamate?
The InChIKey is XZRMUAVNPSKDFK-KNBWSUOLSA-N. The full InChI is InChI=1S/C12H22NO2.3CH3.Sn/c1-7-8-11(6)15-12(14)13(9(2)3)10(4)5;;;;/h7-10H,1-6H3;3*1H3;/b11-8-;;;;.
What are the key properties of [(Z)-4-trimethylstannylpent-2-en-2-yl] N,N-di(propan-2-yl)carbamate?
[(Z)-4-trimethylstannylpent-2-en-2-yl] N,N-di(propan-2-yl)carbamate has a molecular weight of 376.13 g/mol, XLogP of 4.87, 5 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for [(Z)-4-trimethylstannylpent-2-en-2-yl] N,N-di(propan-2-yl)carbamate is sourced from PubChem (CID 14492456), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).