tert-butyl N-(5-methylfuran-3-yl)carbamate

C10H15NO3 — CID 130056498

IUPACtert-butyl N-(5-methylfuran-3-yl)carbamate
SMILESCc1cc(NC(=O)OC(C)(C)C)co1
InChIInChI=1S/C10H15NO3/c1-7-5-8(6-13-7)11-9(12)14-10(2,3)4/h5-6H,1-4H3,(H,11,12)
InChIKeyZYVJROXHVYMVHG-UHFFFAOYSA-N
MW197.23 g/mol
LogP2.94
Rot. Bonds1

About tert-butyl N-(5-methylfuran-3-yl)carbamate

tert-butyl N-(5-methylfuran-3-yl)carbamate (PubChem CID 130056498) has the molecular formula C10H15NO3 and a molecular weight of 197.23 g/mol. Its IUPAC name is tert-butyl N-(5-methylfuran-3-yl)carbamate.

Molecular Properties

Compound Nametert-butyl N-(5-methylfuran-3-yl)carbamate
PubChem CID130056498
Molecular FormulaC10H15NO3
Molecular Weight197.23 g/mol
Exact Mass197.11
IUPAC Nametert-butyl N-(5-methylfuran-3-yl)carbamate
SMILESCc1cc(NC(=O)OC(C)(C)C)co1
InChIInChI=1S/C10H15NO3/c1-7-5-8(6-13-7)11-9(12)14-10(2,3)4/h5-6H,1-4H3,(H,11,12)
InChIKeyZYVJROXHVYMVHG-UHFFFAOYSA-N
XLogP2.94
TPSA51.47 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds1
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500197.23
LogP ≤ 52.94
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

tert-butyl N-[3-methyl-5-[(2-methylpropan-2-yl)oxycarbonylamino]phenyl]carbamate
CID 123753749
tert-butyl N-(3,5-dimethylphenyl)carbamate;ethane
CID 143766104
tert-butyl N-(3-hydroxy-5-methylphenyl)carbamate
CID 22033548
tert-butyl N-[3-methyl-4-[2-methyl-4-[(2-methylpropan-2-yl)oxycarbonylamino]phenyl]phenyl]carbamate
CID 132820274
tert-butyl N-[3-(hydroxymethyl)-4-methylphenyl]carbamate
CID 58614987
tert-butyl N-[(2R)-1-(5-methylfuran-3-yl)-1-oxopropan-2-yl]carbamate
CID 165465733
[6-[(2-methylpropan-2-yl)oxycarbonylamino]naphthalen-2-yl]oxyboronic acid
CID 66909060
tert-butyl N-(3,5-dinitrosophenyl)carbamate
CID 129228787
tert-butyl N-(2,6-dibromo-4-pyridinyl)carbamate
CID 121232345
CID 164562081
CID 164562081
tert-butyl N-[4-[(5-methylfuran-2-yl)methylamino]phenyl]carbamate
CID 103818453
tert-butyl N-(4-sulfanylphenyl)carbamate
CID 59412418

Frequently Asked Questions

What is the IUPAC name of tert-butyl N-(5-methylfuran-3-yl)carbamate?
The IUPAC name of tert-butyl N-(5-methylfuran-3-yl)carbamate (CID 130056498) is tert-butyl N-(5-methylfuran-3-yl)carbamate.
What is the SMILES notation for tert-butyl N-(5-methylfuran-3-yl)carbamate?
The canonical SMILES for tert-butyl N-(5-methylfuran-3-yl)carbamate is Cc1cc(NC(=O)OC(C)(C)C)co1.
What is the InChIKey of tert-butyl N-(5-methylfuran-3-yl)carbamate?
The InChIKey is ZYVJROXHVYMVHG-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H15NO3/c1-7-5-8(6-13-7)11-9(12)14-10(2,3)4/h5-6H,1-4H3,(H,11,12).
What are the key properties of tert-butyl N-(5-methylfuran-3-yl)carbamate?
tert-butyl N-(5-methylfuran-3-yl)carbamate has a molecular weight of 197.23 g/mol, XLogP of 2.94, 1 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for tert-butyl N-(5-methylfuran-3-yl)carbamate is sourced from PubChem (CID 130056498), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).