tert-butyl N-(7-hydroxynaphthalen-2-yl)carbamate

C15H17NO3 — CID 59683245

IUPACtert-butyl N-(7-hydroxynaphthalen-2-yl)carbamate
SMILESCC(C)(C)OC(=O)Nc1ccc2ccc(O)cc2c1
InChIInChI=1S/C15H17NO3/c1-15(2,3)19-14(18)16-12-6-4-10-5-7-13(17)9-11(10)8-12/h4-9,17H,1-3H3,(H,16,18)
InChIKeyGVCBVLOMQVBFMP-UHFFFAOYSA-N
MW259.31 g/mol
LogP3.89
Rot. Bonds1

About tert-butyl N-(7-hydroxynaphthalen-2-yl)carbamate

tert-butyl N-(7-hydroxynaphthalen-2-yl)carbamate (PubChem CID 59683245) has the molecular formula C15H17NO3 and a molecular weight of 259.31 g/mol. Its IUPAC name is tert-butyl N-(7-hydroxynaphthalen-2-yl)carbamate.

Molecular Properties

Compound Nametert-butyl N-(7-hydroxynaphthalen-2-yl)carbamate
PubChem CID59683245
Molecular FormulaC15H17NO3
Molecular Weight259.31 g/mol
Exact Mass259.12
IUPAC Nametert-butyl N-(7-hydroxynaphthalen-2-yl)carbamate
SMILESCC(C)(C)OC(=O)Nc1ccc2ccc(O)cc2c1
InChIInChI=1S/C15H17NO3/c1-15(2,3)19-14(18)16-12-6-4-10-5-7-13(17)9-11(10)8-12/h4-9,17H,1-3H3,(H,16,18)
InChIKeyGVCBVLOMQVBFMP-UHFFFAOYSA-N
XLogP3.89
TPSA58.56 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds1
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500259.31
LogP ≤ 53.89
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

tert-butyl N-[4-(4-hydroxyphenyl)phenyl]carbamate
CID 53218743
[6-[(2-methylpropan-2-yl)oxycarbonylamino]naphthalen-2-yl]oxyboronic acid
CID 66909060
ethyl N-(6-hydroxynaphthalen-2-yl)carbamate
CID 68802648
tert-butyl N-[3-methyl-4-[2-methyl-4-[(2-methylpropan-2-yl)oxycarbonylamino]phenyl]phenyl]carbamate
CID 132820274
tert-butyl N-(3-acetyl-4-hydroxyphenyl)carbamate
CID 18782933
2-hydroxy-5-[(2-methylpropan-2-yl)oxycarbonylamino]benzoic acid
CID 10377562
tert-butyl N-(5-hydroxy-2-methoxyphenyl)carbamate
CID 152536591
tert-butyl N-[4-[(3-hydroxybenzoyl)amino]phenyl]carbamate
CID 131844196
tert-butyl N-(4-hydroxyphenyl)carbamate;tert-butyl N-(4-hydroxy-2,3,6-trimethylphenyl)carbamate
CID 87634757
tert-butyl N-(3-bicyclo[4.2.0]octa-1(6),2,4-trienyl)carbamate
CID 134368267
tert-butyl N-(4-propan-2-ylphenyl)carbamate
CID 10868278
tert-butyl N-(2-chloro-4-hydroxyphenyl)carbamate
CID 54121498

Frequently Asked Questions

What is the IUPAC name of tert-butyl N-(7-hydroxynaphthalen-2-yl)carbamate?
The IUPAC name of tert-butyl N-(7-hydroxynaphthalen-2-yl)carbamate (CID 59683245) is tert-butyl N-(7-hydroxynaphthalen-2-yl)carbamate.
What is the SMILES notation for tert-butyl N-(7-hydroxynaphthalen-2-yl)carbamate?
The canonical SMILES for tert-butyl N-(7-hydroxynaphthalen-2-yl)carbamate is CC(C)(C)OC(=O)Nc1ccc2ccc(O)cc2c1.
What is the InChIKey of tert-butyl N-(7-hydroxynaphthalen-2-yl)carbamate?
The InChIKey is GVCBVLOMQVBFMP-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H17NO3/c1-15(2,3)19-14(18)16-12-6-4-10-5-7-13(17)9-11(10)8-12/h4-9,17H,1-3H3,(H,16,18).
What are the key properties of tert-butyl N-(7-hydroxynaphthalen-2-yl)carbamate?
tert-butyl N-(7-hydroxynaphthalen-2-yl)carbamate has a molecular weight of 259.31 g/mol, XLogP of 3.89, 1 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for tert-butyl N-(7-hydroxynaphthalen-2-yl)carbamate is sourced from PubChem (CID 59683245), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).