5-cyclohexylpentyl N-ethylidenecarbamate

C14H25NO2 — CID 123633150

IUPAC5-cyclohexylpentyl N-ethylidenecarbamate
SMILESCC=NC(=O)OCCCCCC1CCCCC1
InChIInChI=1S/C14H25NO2/c1-2-15-14(16)17-12-8-4-7-11-13-9-5-3-6-10-13/h2,13H,3-12H2,1H3
InChIKeyYMMNFFQQOUSARJ-UHFFFAOYSA-N
MW239.36 g/mol
LogP4.35
Rot. Bonds6

About 5-cyclohexylpentyl N-ethylidenecarbamate

5-cyclohexylpentyl N-ethylidenecarbamate (PubChem CID 123633150) has the molecular formula C14H25NO2 and a molecular weight of 239.36 g/mol. Its IUPAC name is 5-cyclohexylpentyl N-ethylidenecarbamate.

Molecular Properties

Compound Name5-cyclohexylpentyl N-ethylidenecarbamate
PubChem CID123633150
Molecular FormulaC14H25NO2
Molecular Weight239.36 g/mol
Exact Mass239.19
IUPAC Name5-cyclohexylpentyl N-ethylidenecarbamate
SMILESCC=NC(=O)OCCCCCC1CCCCC1
InChIInChI=1S/C14H25NO2/c1-2-15-14(16)17-12-8-4-7-11-13-9-5-3-6-10-13/h2,13H,3-12H2,1H3
InChIKeyYMMNFFQQOUSARJ-UHFFFAOYSA-N
XLogP4.35
TPSA38.66 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds6
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500239.36
LogP ≤ 54.35
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

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

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Related Compounds

octyl N-(2-methylpropylidene)carbamate
CID 56633136
(5-methyl-2-propan-2-ylcyclohexyl) N-ethylidenecarbamate
CID 57110240
(3-methyl-3-propan-2-ylcyclohexyl) N-ethylidenecarbamate
CID 90993012
3-cyclopentylpropyl N-ethylidenecarbamate
CID 123211187
3-cyclohexylpropyl N-ethylidenecarbamate
CID 123441124
4-cyclopentylbutyl N-ethylidenecarbamate
CID 124024426
ethyl 2-cyclohexyl-N-ethoxycarbonylethanimidate
CID 167496137

Frequently Asked Questions

What is the IUPAC name of 5-cyclohexylpentyl N-ethylidenecarbamate?
The IUPAC name of 5-cyclohexylpentyl N-ethylidenecarbamate (CID 123633150) is 5-cyclohexylpentyl N-ethylidenecarbamate.
What is the SMILES notation for 5-cyclohexylpentyl N-ethylidenecarbamate?
The canonical SMILES for 5-cyclohexylpentyl N-ethylidenecarbamate is CC=NC(=O)OCCCCCC1CCCCC1.
What is the InChIKey of 5-cyclohexylpentyl N-ethylidenecarbamate?
The InChIKey is YMMNFFQQOUSARJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H25NO2/c1-2-15-14(16)17-12-8-4-7-11-13-9-5-3-6-10-13/h2,13H,3-12H2,1H3.
What are the key properties of 5-cyclohexylpentyl N-ethylidenecarbamate?
5-cyclohexylpentyl N-ethylidenecarbamate has a molecular weight of 239.36 g/mol, XLogP of 4.35, 6 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 5-cyclohexylpentyl N-ethylidenecarbamate is sourced from PubChem (CID 123633150), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).