prop-2-enyl N-(cyclohexylmethyl)carbamate

C11H19NO2 — CID 137320456

IUPACprop-2-enyl N-(cyclohexylmethyl)carbamate
SMILESC=CCOC(=O)NCC1CCCCC1
InChIInChI=1S/C11H19NO2/c1-2-8-14-11(13)12-9-10-6-4-3-5-7-10/h2,10H,1,3-9H2,(H,12,13)
InChIKeyFZAWRNPHDOBDNR-UHFFFAOYSA-N
MW197.28 g/mol
LogP2.48
Rot. Bonds4

About prop-2-enyl N-(cyclohexylmethyl)carbamate

prop-2-enyl N-(cyclohexylmethyl)carbamate (PubChem CID 137320456) has the molecular formula C11H19NO2 and a molecular weight of 197.28 g/mol. Its IUPAC name is prop-2-enyl N-(cyclohexylmethyl)carbamate.

Molecular Properties

Compound Nameprop-2-enyl N-(cyclohexylmethyl)carbamate
PubChem CID137320456
Molecular FormulaC11H19NO2
Molecular Weight197.28 g/mol
Exact Mass197.14
IUPAC Nameprop-2-enyl N-(cyclohexylmethyl)carbamate
SMILESC=CCOC(=O)NCC1CCCCC1
InChIInChI=1S/C11H19NO2/c1-2-8-14-11(13)12-9-10-6-4-3-5-7-10/h2,10H,1,3-9H2,(H,12,13)
InChIKeyFZAWRNPHDOBDNR-UHFFFAOYSA-N
XLogP2.48
TPSA38.33 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500197.28
LogP ≤ 52.48
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

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

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Related Compounds

prop-2-enyl N-cyclohexylcarbamate
CID 11126927
ethyl N-(cyclohexylmethyl)carbamate;molecular hydrogen
CID 144717784
N-(cyclohexylmethyl)-2-(prop-2-enylamino)acetamide
CID 78908843
1-(cyclobutylmethyl)-3-(cyclohexylmethyl)urea
CID 155200065
prop-2-enyl cyclododecanecarboxylate
CID 139624721
2-amino-N-(cyclohexylmethyl)propanamide
CID 43215382
(3S)-5-(3-cyclohexylpropanoyloxy)-4-oxo-3-(prop-2-enoxycarbonylamino)pentanoic acid
CID 10248513
N-(cyclohexylmethyl)-4-prop-2-enoxybenzamide
CID 55570164
2-(cyclohexylmethylcarbamoylamino)ethyl prop-2-enoate
CID 146561836
2-(cyclohexylmethylamino)-N-prop-2-enylpropanamide
CID 43216208
2-amino-N-(cyclooctylmethyl)propanamide;hydrochloride
CID 119299452
[cyclohexyl(cyclohexylmethylcarbamoyloxy)methyl] 2-methylpropanoate
CID 68568734

Frequently Asked Questions

What is the IUPAC name of prop-2-enyl N-(cyclohexylmethyl)carbamate?
The IUPAC name of prop-2-enyl N-(cyclohexylmethyl)carbamate (CID 137320456) is prop-2-enyl N-(cyclohexylmethyl)carbamate.
What is the SMILES notation for prop-2-enyl N-(cyclohexylmethyl)carbamate?
The canonical SMILES for prop-2-enyl N-(cyclohexylmethyl)carbamate is C=CCOC(=O)NCC1CCCCC1.
What is the InChIKey of prop-2-enyl N-(cyclohexylmethyl)carbamate?
The InChIKey is FZAWRNPHDOBDNR-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H19NO2/c1-2-8-14-11(13)12-9-10-6-4-3-5-7-10/h2,10H,1,3-9H2,(H,12,13).
What are the key properties of prop-2-enyl N-(cyclohexylmethyl)carbamate?
prop-2-enyl N-(cyclohexylmethyl)carbamate has a molecular weight of 197.28 g/mol, XLogP of 2.48, 4 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for prop-2-enyl N-(cyclohexylmethyl)carbamate is sourced from PubChem (CID 137320456), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).