(4-hydroxyphenyl) N-tert-butylcarbamate

C11H15NO3 — CID 19747177

IUPAC(4-hydroxyphenyl) N-tert-butylcarbamate
SMILESCC(C)(C)NC(=O)Oc1ccc(O)cc1
InChIInChI=1S/C11H15NO3/c1-11(2,3)12-10(14)15-9-6-4-8(13)5-7-9/h4-7,13H,1-3H3,(H,12,14)
InChIKeyXVSHRJVEEIXESL-UHFFFAOYSA-N
MW209.25 g/mol
LogP2.28
Rot. Bonds1

About (4-hydroxyphenyl) N-tert-butylcarbamate

(4-hydroxyphenyl) N-tert-butylcarbamate (PubChem CID 19747177) has the molecular formula C11H15NO3 and a molecular weight of 209.25 g/mol. Its IUPAC name is (4-hydroxyphenyl) N-tert-butylcarbamate.

Molecular Properties

Compound Name(4-hydroxyphenyl) N-tert-butylcarbamate
PubChem CID19747177
Molecular FormulaC11H15NO3
Molecular Weight209.25 g/mol
Exact Mass209.11
IUPAC Name(4-hydroxyphenyl) N-tert-butylcarbamate
SMILESCC(C)(C)NC(=O)Oc1ccc(O)cc1
InChIInChI=1S/C11H15NO3/c1-11(2,3)12-10(14)15-9-6-4-8(13)5-7-9/h4-7,13H,1-3H3,(H,12,14)
InChIKeyXVSHRJVEEIXESL-UHFFFAOYSA-N
XLogP2.28
TPSA58.56 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds1
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500209.25
LogP ≤ 52.28
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

(7-hydroxynaphthalen-2-yl) N-tert-butylcarbamate
CID 91617195
(4-hydroxyphenyl) 2-methyl-2-[(2-methylpropan-2-yl)oxycarbonylamino]propanoate
CID 90910009
(7-methoxynaphthalen-2-yl) N-tert-butylcarbamate
CID 174705376
(3-amino-4-methylphenyl) N-tert-butylcarbamate
CID 68878688
[4-(2-amino-2-hydroxyiminoethyl)phenyl] N-tert-butylcarbamate
CID 175154963
(3,5-dichlorophenyl) N-tert-butylcarbamate
CID 174575887
5,6,7,8-tetrahydronaphthalen-2-yl N-tert-butylcarbamate
CID 11311209
(6-methylsulfanyl-3-pyridinyl) N-tert-butylcarbamate
CID 174617515
tert-butyl (4-hydroxyphenyl) carbonate
CID 22345869
[4-(4-hydroxybenzoyl)phenyl] N-methylcarbamate
CID 117058910
[4-[(2-aminopropanoylamino)methyl]phenyl] N-tert-butylcarbamate
CID 174977406
[4-[(2-fluorobenzoyl)amino]phenyl] N-tert-butylcarbamate
CID 174384480

Frequently Asked Questions

What is the IUPAC name of (4-hydroxyphenyl) N-tert-butylcarbamate?
The IUPAC name of (4-hydroxyphenyl) N-tert-butylcarbamate (CID 19747177) is (4-hydroxyphenyl) N-tert-butylcarbamate.
What is the SMILES notation for (4-hydroxyphenyl) N-tert-butylcarbamate?
The canonical SMILES for (4-hydroxyphenyl) N-tert-butylcarbamate is CC(C)(C)NC(=O)Oc1ccc(O)cc1.
What is the InChIKey of (4-hydroxyphenyl) N-tert-butylcarbamate?
The InChIKey is XVSHRJVEEIXESL-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H15NO3/c1-11(2,3)12-10(14)15-9-6-4-8(13)5-7-9/h4-7,13H,1-3H3,(H,12,14).
What are the key properties of (4-hydroxyphenyl) N-tert-butylcarbamate?
(4-hydroxyphenyl) N-tert-butylcarbamate has a molecular weight of 209.25 g/mol, XLogP of 2.28, 1 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for (4-hydroxyphenyl) N-tert-butylcarbamate is sourced from PubChem (CID 19747177), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).