cyclohexyl N-(2,5-dimethylphenyl)carbamate

C15H21NO2 — CID 3262624

IUPACcyclohexyl N-(2,5-dimethylphenyl)carbamate
SMILESCc1ccc(C)c(NC(=O)OC2CCCCC2)c1
InChIInChI=1S/C15H21NO2/c1-11-8-9-12(2)14(10-11)16-15(17)18-13-6-4-3-5-7-13/h8-10,13H,3-7H2,1-2H3,(H,16,17)
InChIKeyROBWGRWOWRARJS-UHFFFAOYSA-N
MW247.34 g/mol
LogP4.18
Rot. Bonds2

About cyclohexyl N-(2,5-dimethylphenyl)carbamate

cyclohexyl N-(2,5-dimethylphenyl)carbamate (PubChem CID 3262624) has the molecular formula C15H21NO2 and a molecular weight of 247.34 g/mol. Its IUPAC name is cyclohexyl N-(2,5-dimethylphenyl)carbamate.

Molecular Properties

Compound Namecyclohexyl N-(2,5-dimethylphenyl)carbamate
PubChem CID3262624
Molecular FormulaC15H21NO2
Molecular Weight247.34 g/mol
Exact Mass247.16
IUPAC Namecyclohexyl N-(2,5-dimethylphenyl)carbamate
SMILESCc1ccc(C)c(NC(=O)OC2CCCCC2)c1
InChIInChI=1S/C15H21NO2/c1-11-8-9-12(2)14(10-11)16-15(17)18-13-6-4-3-5-7-13/h8-10,13H,3-7H2,1-2H3,(H,16,17)
InChIKeyROBWGRWOWRARJS-UHFFFAOYSA-N
XLogP4.18
TPSA38.33 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500247.34
LogP ≤ 54.18
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

cyclohexyl N-(5-chloro-2-methylphenyl)carbamate
CID 4569721
cyclopentyl N-(2-hydroxy-4-methylphenyl)carbamate
CID 112738572
cyclopentyl N-(4-methyl-2-nitrophenyl)carbamate
CID 4548221
cyclopentyl N-(2-bromo-4,6-dimethylphenyl)carbamate
CID 112738566
1-(2,5-dimethylphenyl)-3-(2-hydroxycyclohexyl)urea
CID 75948752
1-cyclooctyl-3-(2,5-dimethylphenyl)thiourea
CID 19650520
N-(2,5-dimethylphenyl)-2-(2-methylpiperidin-1-yl)-2-oxoacetamide
CID 47336445
tert-butyl N-(2,5-dimethylphenyl)carbamate
CID 4935481
cyclopentyl N-(4-chloro-2-fluorophenyl)carbamate
CID 112738809
N-(2,5-dimethylphenyl)piperidine-4-carboxamide
CID 18073176
N-(2,5-dimethylphenyl)-1-methylcyclohexane-1-carboxamide
CID 56695193
(4aS,8aR)-N-(2,5-dimethylphenyl)-3,4,4a,5,6,7,8,8a-octahydro-1H-isoquinoline-2-carboxamide
CID 51943981

Frequently Asked Questions

What is the IUPAC name of cyclohexyl N-(2,5-dimethylphenyl)carbamate?
The IUPAC name of cyclohexyl N-(2,5-dimethylphenyl)carbamate (CID 3262624) is cyclohexyl N-(2,5-dimethylphenyl)carbamate.
What is the SMILES notation for cyclohexyl N-(2,5-dimethylphenyl)carbamate?
The canonical SMILES for cyclohexyl N-(2,5-dimethylphenyl)carbamate is Cc1ccc(C)c(NC(=O)OC2CCCCC2)c1.
What is the InChIKey of cyclohexyl N-(2,5-dimethylphenyl)carbamate?
The InChIKey is ROBWGRWOWRARJS-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H21NO2/c1-11-8-9-12(2)14(10-11)16-15(17)18-13-6-4-3-5-7-13/h8-10,13H,3-7H2,1-2H3,(H,16,17).
What are the key properties of cyclohexyl N-(2,5-dimethylphenyl)carbamate?
cyclohexyl N-(2,5-dimethylphenyl)carbamate has a molecular weight of 247.34 g/mol, XLogP of 4.18, 2 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for cyclohexyl N-(2,5-dimethylphenyl)carbamate is sourced from PubChem (CID 3262624), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).