(4-phenylphenyl)methyl N-cyclohexylcarbamate

C20H23NO2 — CID 22978794

IUPAC(4-phenylphenyl)methyl N-cyclohexylcarbamate
SMILESO=C(NC1CCCCC1)OCc1ccc(-c2ccccc2)cc1
InChIInChI=1S/C20H23NO2/c22-20(21-19-9-5-2-6-10-19)23-15-16-11-13-18(14-12-16)17-7-3-1-4-8-17/h1,3-4,7-8,11-14,19H,2,5-6,9-10,15H2,(H,21,22)
InChIKeySSECCMDRMVCCAD-UHFFFAOYSA-N
MW309.41 g/mol
LogP4.91
Rot. Bonds4

About (4-phenylphenyl)methyl N-cyclohexylcarbamate

(4-phenylphenyl)methyl N-cyclohexylcarbamate (PubChem CID 22978794) has the molecular formula C20H23NO2 and a molecular weight of 309.41 g/mol. Its IUPAC name is (4-phenylphenyl)methyl N-cyclohexylcarbamate.

Molecular Properties

Compound Name(4-phenylphenyl)methyl N-cyclohexylcarbamate
PubChem CID22978794
Molecular FormulaC20H23NO2
Molecular Weight309.41 g/mol
Exact Mass309.17
IUPAC Name(4-phenylphenyl)methyl N-cyclohexylcarbamate
SMILESO=C(NC1CCCCC1)OCc1ccc(-c2ccccc2)cc1
InChIInChI=1S/C20H23NO2/c22-20(21-19-9-5-2-6-10-19)23-15-16-11-13-18(14-12-16)17-7-3-1-4-8-17/h1,3-4,7-8,11-14,19H,2,5-6,9-10,15H2,(H,21,22)
InChIKeySSECCMDRMVCCAD-UHFFFAOYSA-N
XLogP4.91
TPSA38.33 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500309.41
LogP ≤ 54.91
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of (4-phenylphenyl)methyl N-cyclohexylcarbamate?
The IUPAC name of (4-phenylphenyl)methyl N-cyclohexylcarbamate (CID 22978794) is (4-phenylphenyl)methyl N-cyclohexylcarbamate.
What is the SMILES notation for (4-phenylphenyl)methyl N-cyclohexylcarbamate?
The canonical SMILES for (4-phenylphenyl)methyl N-cyclohexylcarbamate is O=C(NC1CCCCC1)OCc1ccc(-c2ccccc2)cc1.
What is the InChIKey of (4-phenylphenyl)methyl N-cyclohexylcarbamate?
The InChIKey is SSECCMDRMVCCAD-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H23NO2/c22-20(21-19-9-5-2-6-10-19)23-15-16-11-13-18(14-12-16)17-7-3-1-4-8-17/h1,3-4,7-8,11-14,19H,2,5-6,9-10,15H2,(H,21,22).
What are the key properties of (4-phenylphenyl)methyl N-cyclohexylcarbamate?
(4-phenylphenyl)methyl N-cyclohexylcarbamate has a molecular weight of 309.41 g/mol, XLogP of 4.91, 4 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for (4-phenylphenyl)methyl N-cyclohexylcarbamate is sourced from PubChem (CID 22978794), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).