cyclohexyl N-(3-phenylphenyl)carbamate

C19H21NO2 — CID 10979337

IUPACcyclohexyl N-(3-phenylphenyl)carbamate
SMILESO=C(Nc1cccc(-c2ccccc2)c1)OC1CCCCC1
InChIInChI=1S/C19H21NO2/c21-19(22-18-12-5-2-6-13-18)20-17-11-7-10-16(14-17)15-8-3-1-4-9-15/h1,3-4,7-11,14,18H,2,5-6,12-13H2,(H,20,21)
InChIKeyHHVUFQYJOSFTEH-UHFFFAOYSA-N
MW295.38 g/mol
LogP5.23
Rot. Bonds3

About cyclohexyl N-(3-phenylphenyl)carbamate

cyclohexyl N-(3-phenylphenyl)carbamate (PubChem CID 10979337) has the molecular formula C19H21NO2 and a molecular weight of 295.38 g/mol. Its IUPAC name is cyclohexyl N-(3-phenylphenyl)carbamate.

Molecular Properties

Compound Namecyclohexyl N-(3-phenylphenyl)carbamate
PubChem CID10979337
Molecular FormulaC19H21NO2
Molecular Weight295.38 g/mol
Exact Mass295.16
IUPAC Namecyclohexyl N-(3-phenylphenyl)carbamate
SMILESO=C(Nc1cccc(-c2ccccc2)c1)OC1CCCCC1
InChIInChI=1S/C19H21NO2/c21-19(22-18-12-5-2-6-13-18)20-17-11-7-10-16(14-17)15-8-3-1-4-9-15/h1,3-4,7-11,14,18H,2,5-6,12-13H2,(H,20,21)
InChIKeyHHVUFQYJOSFTEH-UHFFFAOYSA-N
XLogP5.23
TPSA38.33 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms22
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500295.38
LogP ≤ 55.23
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of cyclohexyl N-(3-phenylphenyl)carbamate?
The IUPAC name of cyclohexyl N-(3-phenylphenyl)carbamate (CID 10979337) is cyclohexyl N-(3-phenylphenyl)carbamate.
What is the SMILES notation for cyclohexyl N-(3-phenylphenyl)carbamate?
The canonical SMILES for cyclohexyl N-(3-phenylphenyl)carbamate is O=C(Nc1cccc(-c2ccccc2)c1)OC1CCCCC1.
What is the InChIKey of cyclohexyl N-(3-phenylphenyl)carbamate?
The InChIKey is HHVUFQYJOSFTEH-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H21NO2/c21-19(22-18-12-5-2-6-13-18)20-17-11-7-10-16(14-17)15-8-3-1-4-9-15/h1,3-4,7-11,14,18H,2,5-6,12-13H2,(H,20,21).
What are the key properties of cyclohexyl N-(3-phenylphenyl)carbamate?
cyclohexyl N-(3-phenylphenyl)carbamate has a molecular weight of 295.38 g/mol, XLogP of 5.23, 3 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for cyclohexyl N-(3-phenylphenyl)carbamate is sourced from PubChem (CID 10979337), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).