(3-phenylphenyl) N-(cyclohexylmethyl)carbamate

C20H23NO2 — CID 24881675

IUPAC(3-phenylphenyl) N-(cyclohexylmethyl)carbamate
SMILESO=C(NCC1CCCCC1)Oc1cccc(-c2ccccc2)c1
InChIInChI=1S/C20H23NO2/c22-20(21-15-16-8-3-1-4-9-16)23-19-13-7-12-18(14-19)17-10-5-2-6-11-17/h2,5-7,10-14,16H,1,3-4,8-9,15H2,(H,21,22)
InChIKeyAARHPAICPBZNBZ-UHFFFAOYSA-N
MW309.41 g/mol
LogP5.02
Rot. Bonds4

About (3-phenylphenyl) N-(cyclohexylmethyl)carbamate

(3-phenylphenyl) N-(cyclohexylmethyl)carbamate (PubChem CID 24881675) has the molecular formula C20H23NO2 and a molecular weight of 309.41 g/mol. Its IUPAC name is (3-phenylphenyl) N-(cyclohexylmethyl)carbamate.

Molecular Properties

Compound Name(3-phenylphenyl) N-(cyclohexylmethyl)carbamate
PubChem CID24881675
Molecular FormulaC20H23NO2
Molecular Weight309.41 g/mol
Exact Mass309.17
IUPAC Name(3-phenylphenyl) N-(cyclohexylmethyl)carbamate
SMILESO=C(NCC1CCCCC1)Oc1cccc(-c2ccccc2)c1
InChIInChI=1S/C20H23NO2/c22-20(21-15-16-8-3-1-4-9-16)23-19-13-7-12-18(14-19)17-10-5-2-6-11-17/h2,5-7,10-14,16H,1,3-4,8-9,15H2,(H,21,22)
InChIKeyAARHPAICPBZNBZ-UHFFFAOYSA-N
XLogP5.02
TPSA38.33 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms23
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500309.41
LogP ≤ 55.02
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Analyze (3-phenylphenyl) N-(cyclohexylmethyl)carbamate with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Frequently Asked Questions

What is the IUPAC name of (3-phenylphenyl) N-(cyclohexylmethyl)carbamate?
The IUPAC name of (3-phenylphenyl) N-(cyclohexylmethyl)carbamate (CID 24881675) is (3-phenylphenyl) N-(cyclohexylmethyl)carbamate.
What is the SMILES notation for (3-phenylphenyl) N-(cyclohexylmethyl)carbamate?
The canonical SMILES for (3-phenylphenyl) N-(cyclohexylmethyl)carbamate is O=C(NCC1CCCCC1)Oc1cccc(-c2ccccc2)c1.
What is the InChIKey of (3-phenylphenyl) N-(cyclohexylmethyl)carbamate?
The InChIKey is AARHPAICPBZNBZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H23NO2/c22-20(21-15-16-8-3-1-4-9-16)23-19-13-7-12-18(14-19)17-10-5-2-6-11-17/h2,5-7,10-14,16H,1,3-4,8-9,15H2,(H,21,22).
What are the key properties of (3-phenylphenyl) N-(cyclohexylmethyl)carbamate?
(3-phenylphenyl) N-(cyclohexylmethyl)carbamate has a molecular weight of 309.41 g/mol, XLogP of 5.02, 4 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for (3-phenylphenyl) N-(cyclohexylmethyl)carbamate is sourced from PubChem (CID 24881675), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).