(4-hydroxy-3-phenylphenyl) N-cyclohexylcarbamate

C19H21NO3 — CID 44626363

IUPAC(4-hydroxy-3-phenylphenyl) N-cyclohexylcarbamate
SMILESO=C(NC1CCCCC1)Oc1ccc(O)c(-c2ccccc2)c1
InChIInChI=1S/C19H21NO3/c21-18-12-11-16(13-17(18)14-7-3-1-4-8-14)23-19(22)20-15-9-5-2-6-10-15/h1,3-4,7-8,11-13,15,21H,2,5-6,9-10H2,(H,20,22)
InChIKeyKRJOFKFEYDSZAV-UHFFFAOYSA-N
MW311.38 g/mol
LogP4.48
Rot. Bonds3

About (4-hydroxy-3-phenylphenyl) N-cyclohexylcarbamate

(4-hydroxy-3-phenylphenyl) N-cyclohexylcarbamate (PubChem CID 44626363) has the molecular formula C19H21NO3 and a molecular weight of 311.38 g/mol. Its IUPAC name is (4-hydroxy-3-phenylphenyl) N-cyclohexylcarbamate.

Molecular Properties

Compound Name(4-hydroxy-3-phenylphenyl) N-cyclohexylcarbamate
PubChem CID44626363
Molecular FormulaC19H21NO3
Molecular Weight311.38 g/mol
Exact Mass311.15
IUPAC Name(4-hydroxy-3-phenylphenyl) N-cyclohexylcarbamate
SMILESO=C(NC1CCCCC1)Oc1ccc(O)c(-c2ccccc2)c1
InChIInChI=1S/C19H21NO3/c21-18-12-11-16(13-17(18)14-7-3-1-4-8-14)23-19(22)20-15-9-5-2-6-10-15/h1,3-4,7-8,11-13,15,21H,2,5-6,9-10H2,(H,20,22)
InChIKeyKRJOFKFEYDSZAV-UHFFFAOYSA-N
XLogP4.48
TPSA58.56 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500311.38
LogP ≤ 54.48
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of (4-hydroxy-3-phenylphenyl) N-cyclohexylcarbamate?
The IUPAC name of (4-hydroxy-3-phenylphenyl) N-cyclohexylcarbamate (CID 44626363) is (4-hydroxy-3-phenylphenyl) N-cyclohexylcarbamate.
What is the SMILES notation for (4-hydroxy-3-phenylphenyl) N-cyclohexylcarbamate?
The canonical SMILES for (4-hydroxy-3-phenylphenyl) N-cyclohexylcarbamate is O=C(NC1CCCCC1)Oc1ccc(O)c(-c2ccccc2)c1.
What is the InChIKey of (4-hydroxy-3-phenylphenyl) N-cyclohexylcarbamate?
The InChIKey is KRJOFKFEYDSZAV-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H21NO3/c21-18-12-11-16(13-17(18)14-7-3-1-4-8-14)23-19(22)20-15-9-5-2-6-10-15/h1,3-4,7-8,11-13,15,21H,2,5-6,9-10H2,(H,20,22).
What are the key properties of (4-hydroxy-3-phenylphenyl) N-cyclohexylcarbamate?
(4-hydroxy-3-phenylphenyl) N-cyclohexylcarbamate has a molecular weight of 311.38 g/mol, XLogP of 4.48, 3 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for (4-hydroxy-3-phenylphenyl) N-cyclohexylcarbamate is sourced from PubChem (CID 44626363), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).