cyclohexyl N-(5-chloro-2-methylphenyl)carbamate

C14H18ClNO2 — CID 4569721

IUPACcyclohexyl N-(5-chloro-2-methylphenyl)carbamate
SMILESCc1ccc(Cl)cc1NC(=O)OC1CCCCC1
InChIInChI=1S/C14H18ClNO2/c1-10-7-8-11(15)9-13(10)16-14(17)18-12-5-3-2-4-6-12/h7-9,12H,2-6H2,1H3,(H,16,17)
InChIKeyYLMQOQGAMIJLIX-UHFFFAOYSA-N
MW267.76 g/mol
LogP4.53
Rot. Bonds2

About cyclohexyl N-(5-chloro-2-methylphenyl)carbamate

cyclohexyl N-(5-chloro-2-methylphenyl)carbamate (PubChem CID 4569721) has the molecular formula C14H18ClNO2 and a molecular weight of 267.76 g/mol. Its IUPAC name is cyclohexyl N-(5-chloro-2-methylphenyl)carbamate.

Molecular Properties

Compound Namecyclohexyl N-(5-chloro-2-methylphenyl)carbamate
PubChem CID4569721
Molecular FormulaC14H18ClNO2
Molecular Weight267.76 g/mol
Exact Mass267.10
IUPAC Namecyclohexyl N-(5-chloro-2-methylphenyl)carbamate
SMILESCc1ccc(Cl)cc1NC(=O)OC1CCCCC1
InChIInChI=1S/C14H18ClNO2/c1-10-7-8-11(15)9-13(10)16-14(17)18-12-5-3-2-4-6-12/h7-9,12H,2-6H2,1H3,(H,16,17)
InChIKeyYLMQOQGAMIJLIX-UHFFFAOYSA-N
XLogP4.53
TPSA38.33 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500267.76
LogP ≤ 54.53
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

cyclohexyl N-(2,5-dimethylphenyl)carbamate
CID 3262624
cyclopentyl N-(4-chloro-2-fluorophenyl)carbamate
CID 112738809
N-(5-chloro-2-methylphenyl)-5-(cyclohexylamino)pyridine-2-carboxamide
CID 109183168
cyclopentyl N-(2-hydroxy-4-methylphenyl)carbamate
CID 112738572
N-(5-chloro-2-methylphenyl)-N'-cyclohexyl-N'-methyloxamide
CID 108503660
N-(5-chloro-2-methylphenyl)-2-(cyclopropylamino)acetamide
CID 43405290
[2-(5-chloro-2-methylanilino)-2-oxoethyl] cyclopentanecarboxylate
CID 2356187
2-piperidin-1-ylethyl N-(5-chloro-2-methylphenyl)carbamate
CID 30014
cyclopentyl N-(2,4-difluorophenyl)carbamate
CID 113218545
N-(5-chloro-2-methylphenyl)-2-(1-cyclohexylethylamino)acetamide
CID 62406464
2-acetamido-N-(5-chloro-2-methylphenyl)-2-cyclopentylacetamide
CID 51272260
N-(5-chloro-2-methylphenyl)piperidine-2-carboxamide;hydrochloride
CID 119264186

Frequently Asked Questions

What is the IUPAC name of cyclohexyl N-(5-chloro-2-methylphenyl)carbamate?
The IUPAC name of cyclohexyl N-(5-chloro-2-methylphenyl)carbamate (CID 4569721) is cyclohexyl N-(5-chloro-2-methylphenyl)carbamate.
What is the SMILES notation for cyclohexyl N-(5-chloro-2-methylphenyl)carbamate?
The canonical SMILES for cyclohexyl N-(5-chloro-2-methylphenyl)carbamate is Cc1ccc(Cl)cc1NC(=O)OC1CCCCC1.
What is the InChIKey of cyclohexyl N-(5-chloro-2-methylphenyl)carbamate?
The InChIKey is YLMQOQGAMIJLIX-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H18ClNO2/c1-10-7-8-11(15)9-13(10)16-14(17)18-12-5-3-2-4-6-12/h7-9,12H,2-6H2,1H3,(H,16,17).
What are the key properties of cyclohexyl N-(5-chloro-2-methylphenyl)carbamate?
cyclohexyl N-(5-chloro-2-methylphenyl)carbamate has a molecular weight of 267.76 g/mol, XLogP of 4.53, 2 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for cyclohexyl N-(5-chloro-2-methylphenyl)carbamate is sourced from PubChem (CID 4569721), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).