tert-butyl N-[4-(4-hydroxyphenyl)phenyl]carbamate

C17H19NO3 — CID 53218743

IUPACtert-butyl N-[4-(4-hydroxyphenyl)phenyl]carbamate
SMILESCC(C)(C)OC(=O)Nc1ccc(-c2ccc(O)cc2)cc1
InChIInChI=1S/C17H19NO3/c1-17(2,3)21-16(20)18-14-8-4-12(5-9-14)13-6-10-15(19)11-7-13/h4-11,19H,1-3H3,(H,18,20)
InChIKeyIJZZTPIOYKYBOI-UHFFFAOYSA-N
MW285.34 g/mol
LogP4.41
Rot. Bonds2

About tert-butyl N-[4-(4-hydroxyphenyl)phenyl]carbamate

tert-butyl N-[4-(4-hydroxyphenyl)phenyl]carbamate (PubChem CID 53218743) has the molecular formula C17H19NO3 and a molecular weight of 285.34 g/mol. Its IUPAC name is tert-butyl N-[4-(4-hydroxyphenyl)phenyl]carbamate.

Molecular Properties

Compound Nametert-butyl N-[4-(4-hydroxyphenyl)phenyl]carbamate
PubChem CID53218743
Molecular FormulaC17H19NO3
Molecular Weight285.34 g/mol
Exact Mass285.14
IUPAC Nametert-butyl N-[4-(4-hydroxyphenyl)phenyl]carbamate
SMILESCC(C)(C)OC(=O)Nc1ccc(-c2ccc(O)cc2)cc1
InChIInChI=1S/C17H19NO3/c1-17(2,3)21-16(20)18-14-8-4-12(5-9-14)13-6-10-15(19)11-7-13/h4-11,19H,1-3H3,(H,18,20)
InChIKeyIJZZTPIOYKYBOI-UHFFFAOYSA-N
XLogP4.41
TPSA58.56 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500285.34
LogP ≤ 54.41
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

Analyze tert-butyl N-[4-(4-hydroxyphenyl)phenyl]carbamate with MolForge

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

Launch Full Analysis

Related Compounds

tert-butyl N-[4-[5-(4-hydroxyphenyl)-1,2,4-oxadiazol-3-yl]phenyl]carbamate
CID 137028383
tert-butyl N-[4-[2-[(4-hydroxybenzoyl)amino]ethylcarbamoyl]phenyl]carbamate
CID 55736690
tert-butyl N-[4-[(1E,6E)-7-(4-hydroxyphenyl)-3,5-dioxohepta-1,6-dienyl]phenyl]carbamate
CID 68551182
tert-butyl N-[4-(3-hydroxy-4-methoxyphenyl)phenyl]carbamate
CID 53221133
tert-butyl N-(4-sulfanylphenyl)carbamate
CID 59412418
tert-butyl N-[4-(6-oxo-1H-pyridin-3-yl)phenyl]carbamate
CID 53218281
tert-butyl N-[4-[2-[(4-hydroxyphenyl)methylamino]-2-oxoethyl]phenyl]carbamate
CID 78847906
tert-butyl N-(7-hydroxynaphthalen-2-yl)carbamate
CID 59683245
tert-butyl N-(4-hydroxyphenyl)carbamate;tert-butyl N-(4-hydroxy-2,3,6-trimethylphenyl)carbamate
CID 87634757
tert-butyl N-[4-(prop-2-enylamino)phenyl]carbamate
CID 112980140
5-[4-[(2-methylpropan-2-yl)oxycarbonylamino]phenyl]pyridine-2-carboxylic acid
CID 53224655
tert-butyl N-[4-[[4-(4-fluorophenyl)phenyl]-hydroxymethyl]phenyl]carbamate
CID 155206873

Frequently Asked Questions

What is the IUPAC name of tert-butyl N-[4-(4-hydroxyphenyl)phenyl]carbamate?
The IUPAC name of tert-butyl N-[4-(4-hydroxyphenyl)phenyl]carbamate (CID 53218743) is tert-butyl N-[4-(4-hydroxyphenyl)phenyl]carbamate.
What is the SMILES notation for tert-butyl N-[4-(4-hydroxyphenyl)phenyl]carbamate?
The canonical SMILES for tert-butyl N-[4-(4-hydroxyphenyl)phenyl]carbamate is CC(C)(C)OC(=O)Nc1ccc(-c2ccc(O)cc2)cc1.
What is the InChIKey of tert-butyl N-[4-(4-hydroxyphenyl)phenyl]carbamate?
The InChIKey is IJZZTPIOYKYBOI-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H19NO3/c1-17(2,3)21-16(20)18-14-8-4-12(5-9-14)13-6-10-15(19)11-7-13/h4-11,19H,1-3H3,(H,18,20).
What are the key properties of tert-butyl N-[4-(4-hydroxyphenyl)phenyl]carbamate?
tert-butyl N-[4-(4-hydroxyphenyl)phenyl]carbamate has a molecular weight of 285.34 g/mol, XLogP of 4.41, 2 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for tert-butyl N-[4-(4-hydroxyphenyl)phenyl]carbamate is sourced from PubChem (CID 53218743), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).