methyl N-cyclohex-2-en-1-yl-N-prop-2-enylcarbamate

C11H17NO2 — CID 10954470

IUPACmethyl N-cyclohex-2-en-1-yl-N-prop-2-enylcarbamate
SMILESC=CCN(C(=O)OC)C1C=CCCC1
InChIInChI=1S/C11H17NO2/c1-3-9-12(11(13)14-2)10-7-5-4-6-8-10/h3,5,7,10H,1,4,6,8-9H2,2H3
InChIKeyMOBUMPZXSHJKLA-UHFFFAOYSA-N
MW195.26 g/mol
LogP2.35
Rot. Bonds3

About methyl N-cyclohex-2-en-1-yl-N-prop-2-enylcarbamate

methyl N-cyclohex-2-en-1-yl-N-prop-2-enylcarbamate (PubChem CID 10954470) has the molecular formula C11H17NO2 and a molecular weight of 195.26 g/mol. Its IUPAC name is methyl N-cyclohex-2-en-1-yl-N-prop-2-enylcarbamate.

Molecular Properties

Compound Namemethyl N-cyclohex-2-en-1-yl-N-prop-2-enylcarbamate
PubChem CID10954470
Molecular FormulaC11H17NO2
Molecular Weight195.26 g/mol
Exact Mass195.13
IUPAC Namemethyl N-cyclohex-2-en-1-yl-N-prop-2-enylcarbamate
SMILESC=CCN(C(=O)OC)C1C=CCCC1
InChIInChI=1S/C11H17NO2/c1-3-9-12(11(13)14-2)10-7-5-4-6-8-10/h3,5,7,10H,1,4,6,8-9H2,2H3
InChIKeyMOBUMPZXSHJKLA-UHFFFAOYSA-N
XLogP2.35
TPSA29.54 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500195.26
LogP ≤ 52.35
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

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

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Related Compounds

Ethyl 8-azabicyclo[3.2.1]oct-2-ene-8-carboxylate
CID 556818
methyl N-cyclohex-2-en-1-yl-N-prop-2-ynylcarbamate
CID 139266068
N-Boc-2-(cis-1-Propenyl)Piperidine
CID 67498933
methyl 3,4,5,8-tetrahydro-1H-isoquinoline-2-carboxylate
CID 155934530
N-Ethoxycarbonyl-7-azabicyclo(2,2,1)hept-2-ene
CID 534131
1(2h)-Pyridinecarboxylic acid,5,6-dihydro-2-(2-propenyl)-,methyl ester
CID 11229141
Methyl 2-allylpiperidine-1-carboxylate
CID 11412765
methyl 2-butyl-2H-pyridine-1-carboxylate
CID 12416609
Methyl 7-azabicyclo[4.1.0]hept-3-ene-7-carboxylate
CID 45090129
Methyl 2,6-bis(prop-2-enyl)piperidine-1-carboxylate
CID 85420103
tert-butyl (2R)-2-[(E)-prop-1-enyl]piperidine-1-carboxylate
CID 124490920
methyl 3,6-dimethyl-3,6-dihydro-2H-pyridine-1-carboxylate
CID 134994239

Frequently Asked Questions

What is the IUPAC name of methyl N-cyclohex-2-en-1-yl-N-prop-2-enylcarbamate?
The IUPAC name of methyl N-cyclohex-2-en-1-yl-N-prop-2-enylcarbamate (CID 10954470) is methyl N-cyclohex-2-en-1-yl-N-prop-2-enylcarbamate.
What is the SMILES notation for methyl N-cyclohex-2-en-1-yl-N-prop-2-enylcarbamate?
The canonical SMILES for methyl N-cyclohex-2-en-1-yl-N-prop-2-enylcarbamate is C=CCN(C(=O)OC)C1C=CCCC1.
What is the InChIKey of methyl N-cyclohex-2-en-1-yl-N-prop-2-enylcarbamate?
The InChIKey is MOBUMPZXSHJKLA-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H17NO2/c1-3-9-12(11(13)14-2)10-7-5-4-6-8-10/h3,5,7,10H,1,4,6,8-9H2,2H3.
What are the key properties of methyl N-cyclohex-2-en-1-yl-N-prop-2-enylcarbamate?
methyl N-cyclohex-2-en-1-yl-N-prop-2-enylcarbamate has a molecular weight of 195.26 g/mol, XLogP of 2.35, 3 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for methyl N-cyclohex-2-en-1-yl-N-prop-2-enylcarbamate is sourced from PubChem (CID 10954470), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).