cyclohexyl 1-(ethylideneamino)ethyl carbonate

C11H19NO3 — CID 163564117

IUPACcyclohexyl 1-(ethylideneamino)ethyl carbonate
SMILESCC=NC(C)OC(=O)OC1CCCCC1
InChIInChI=1S/C11H19NO3/c1-3-12-9(2)14-11(13)15-10-7-5-4-6-8-10/h3,9-10H,4-8H2,1-2H3
InChIKeyFTSWJDXIKUKRHT-UHFFFAOYSA-N
MW213.28 g/mol
LogP2.91
Rot. Bonds3

About cyclohexyl 1-(ethylideneamino)ethyl carbonate

cyclohexyl 1-(ethylideneamino)ethyl carbonate (PubChem CID 163564117) has the molecular formula C11H19NO3 and a molecular weight of 213.28 g/mol. Its IUPAC name is cyclohexyl 1-(ethylideneamino)ethyl carbonate.

Molecular Properties

Compound Namecyclohexyl 1-(ethylideneamino)ethyl carbonate
PubChem CID163564117
Molecular FormulaC11H19NO3
Molecular Weight213.28 g/mol
Exact Mass213.14
IUPAC Namecyclohexyl 1-(ethylideneamino)ethyl carbonate
SMILESCC=NC(C)OC(=O)OC1CCCCC1
InChIInChI=1S/C11H19NO3/c1-3-12-9(2)14-11(13)15-10-7-5-4-6-8-10/h3,9-10H,4-8H2,1-2H3
InChIKeyFTSWJDXIKUKRHT-UHFFFAOYSA-N
XLogP2.91
TPSA47.89 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500213.28
LogP ≤ 52.91
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'imine_1', 'substructure': 'N/A'}

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Related Compounds

dicyclononyl carbonate
CID 139618210
cyclohexyl (4-methoxycarbonyloxycyclohexyl) carbonate
CID 23066096
cyclohexyl N-ethylidenecarbamate
CID 56637848
cyclodecyl cyclodecyloxycarbonyloxy carbonate
CID 139793916
cycloheptyl (2R)-2-amino-4-methylpentanoate
CID 78976122
cyclohexyl 1-(1-hydroxy-2,2-dimethylbut-3-enoxy)ethyl carbonate
CID 163819427
1-O-cyclohexyl 4-O-propan-2-yl (E)-but-2-enedioate
CID 68672121
cyclopentyl 1-iodopropyl carbonate
CID 19894514
[3,5-bis(cyclohexyloxycarbonyloxy)cyclohexyl] cyclohexyl carbonate
CID 23066782
cyclohexyl iodo carbonate
CID 139427010
[(2S)-1-cyclohexyloxy-1-oxopropan-2-yl]azanium
CID 86325429
cycloheptyl 2-aminopropanoate;hydrochloride
CID 74957485

Frequently Asked Questions

What is the IUPAC name of cyclohexyl 1-(ethylideneamino)ethyl carbonate?
The IUPAC name of cyclohexyl 1-(ethylideneamino)ethyl carbonate (CID 163564117) is cyclohexyl 1-(ethylideneamino)ethyl carbonate.
What is the SMILES notation for cyclohexyl 1-(ethylideneamino)ethyl carbonate?
The canonical SMILES for cyclohexyl 1-(ethylideneamino)ethyl carbonate is CC=NC(C)OC(=O)OC1CCCCC1.
What is the InChIKey of cyclohexyl 1-(ethylideneamino)ethyl carbonate?
The InChIKey is FTSWJDXIKUKRHT-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H19NO3/c1-3-12-9(2)14-11(13)15-10-7-5-4-6-8-10/h3,9-10H,4-8H2,1-2H3.
What are the key properties of cyclohexyl 1-(ethylideneamino)ethyl carbonate?
cyclohexyl 1-(ethylideneamino)ethyl carbonate has a molecular weight of 213.28 g/mol, XLogP of 2.91, 3 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for cyclohexyl 1-(ethylideneamino)ethyl carbonate is sourced from PubChem (CID 163564117), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).