(4-methylphenyl) N-cyclohexylcarbamate

C14H19NO2 — CID 4146128

IUPAC(4-methylphenyl) N-cyclohexylcarbamate
SMILESCc1ccc(OC(=O)NC2CCCCC2)cc1
InChIInChI=1S/C14H19NO2/c1-11-7-9-13(10-8-11)17-14(16)15-12-5-3-2-4-6-12/h7-10,12H,2-6H2,1H3,(H,15,16)
InChIKeyJILNDALVSVRTPX-UHFFFAOYSA-N
MW233.31 g/mol
LogP3.42
Rot. Bonds2

About (4-methylphenyl) N-cyclohexylcarbamate

(4-methylphenyl) N-cyclohexylcarbamate (PubChem CID 4146128) has the molecular formula C14H19NO2 and a molecular weight of 233.31 g/mol. Its IUPAC name is (4-methylphenyl) N-cyclohexylcarbamate.

Molecular Properties

Compound Name(4-methylphenyl) N-cyclohexylcarbamate
PubChem CID4146128
Molecular FormulaC14H19NO2
Molecular Weight233.31 g/mol
Exact Mass233.14
IUPAC Name(4-methylphenyl) N-cyclohexylcarbamate
SMILESCc1ccc(OC(=O)NC2CCCCC2)cc1
InChIInChI=1S/C14H19NO2/c1-11-7-9-13(10-8-11)17-14(16)15-12-5-3-2-4-6-12/h7-10,12H,2-6H2,1H3,(H,15,16)
InChIKeyJILNDALVSVRTPX-UHFFFAOYSA-N
XLogP3.42
TPSA38.33 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500233.31
LogP ≤ 53.42
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of (4-methylphenyl) N-cyclohexylcarbamate?
The IUPAC name of (4-methylphenyl) N-cyclohexylcarbamate (CID 4146128) is (4-methylphenyl) N-cyclohexylcarbamate.
What is the SMILES notation for (4-methylphenyl) N-cyclohexylcarbamate?
The canonical SMILES for (4-methylphenyl) N-cyclohexylcarbamate is Cc1ccc(OC(=O)NC2CCCCC2)cc1.
What is the InChIKey of (4-methylphenyl) N-cyclohexylcarbamate?
The InChIKey is JILNDALVSVRTPX-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H19NO2/c1-11-7-9-13(10-8-11)17-14(16)15-12-5-3-2-4-6-12/h7-10,12H,2-6H2,1H3,(H,15,16).
What are the key properties of (4-methylphenyl) N-cyclohexylcarbamate?
(4-methylphenyl) N-cyclohexylcarbamate has a molecular weight of 233.31 g/mol, XLogP of 3.42, 2 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for (4-methylphenyl) N-cyclohexylcarbamate is sourced from PubChem (CID 4146128), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).