ethyl N-(4-methylcyclohexyl)carbamate

C10H19NO2 — CID 57270140

IUPACethyl N-(4-methylcyclohexyl)carbamate
SMILESCCOC(=O)NC1CCC(C)CC1
InChIInChI=1S/C10H19NO2/c1-3-13-10(12)11-9-6-4-8(2)5-7-9/h8-9H,3-7H2,1-2H3,(H,11,12)
InChIKeyFYJSVRAXJXELOA-UHFFFAOYSA-N
MW185.27 g/mol
LogP2.31
Rot. Bonds2

About ethyl N-(4-methylcyclohexyl)carbamate

ethyl N-(4-methylcyclohexyl)carbamate (PubChem CID 57270140) has the molecular formula C10H19NO2 and a molecular weight of 185.27 g/mol. Its IUPAC name is ethyl N-(4-methylcyclohexyl)carbamate.

Molecular Properties

Compound Nameethyl N-(4-methylcyclohexyl)carbamate
PubChem CID57270140
Molecular FormulaC10H19NO2
Molecular Weight185.27 g/mol
Exact Mass185.14
IUPAC Nameethyl N-(4-methylcyclohexyl)carbamate
SMILESCCOC(=O)NC1CCC(C)CC1
InChIInChI=1S/C10H19NO2/c1-3-13-10(12)11-9-6-4-8(2)5-7-9/h8-9H,3-7H2,1-2H3,(H,11,12)
InChIKeyFYJSVRAXJXELOA-UHFFFAOYSA-N
XLogP2.31
TPSA38.33 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500185.27
LogP ≤ 52.31
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of ethyl N-(4-methylcyclohexyl)carbamate?
The IUPAC name of ethyl N-(4-methylcyclohexyl)carbamate (CID 57270140) is ethyl N-(4-methylcyclohexyl)carbamate.
What is the SMILES notation for ethyl N-(4-methylcyclohexyl)carbamate?
The canonical SMILES for ethyl N-(4-methylcyclohexyl)carbamate is CCOC(=O)NC1CCC(C)CC1.
What is the InChIKey of ethyl N-(4-methylcyclohexyl)carbamate?
The InChIKey is FYJSVRAXJXELOA-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H19NO2/c1-3-13-10(12)11-9-6-4-8(2)5-7-9/h8-9H,3-7H2,1-2H3,(H,11,12).
What are the key properties of ethyl N-(4-methylcyclohexyl)carbamate?
ethyl N-(4-methylcyclohexyl)carbamate has a molecular weight of 185.27 g/mol, XLogP of 2.31, 2 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for ethyl N-(4-methylcyclohexyl)carbamate is sourced from PubChem (CID 57270140), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).