tert-butyl N-(furan-3-carbonyl)carbamate

C10H13NO4 — CID 176560288

IUPACtert-butyl N-(furan-3-carbonyl)carbamate
SMILESCC(C)(C)OC(=O)NC(=O)c1ccoc1
InChIInChI=1S/C10H13NO4/c1-10(2,3)15-9(13)11-8(12)7-4-5-14-6-7/h4-6H,1-3H3,(H,11,12,13)
InChIKeyHZZOBWVBKJMDJB-UHFFFAOYSA-N
MW211.22 g/mol
LogP1.94
Rot. Bonds1

About tert-butyl N-(furan-3-carbonyl)carbamate

tert-butyl N-(furan-3-carbonyl)carbamate (PubChem CID 176560288) has the molecular formula C10H13NO4 and a molecular weight of 211.22 g/mol. Its IUPAC name is tert-butyl N-(furan-3-carbonyl)carbamate.

Molecular Properties

Compound Nametert-butyl N-(furan-3-carbonyl)carbamate
PubChem CID176560288
Molecular FormulaC10H13NO4
Molecular Weight211.22 g/mol
Exact Mass211.08
IUPAC Nametert-butyl N-(furan-3-carbonyl)carbamate
SMILESCC(C)(C)OC(=O)NC(=O)c1ccoc1
InChIInChI=1S/C10H13NO4/c1-10(2,3)15-9(13)11-8(12)7-4-5-14-6-7/h4-6H,1-3H3,(H,11,12,13)
InChIKeyHZZOBWVBKJMDJB-UHFFFAOYSA-N
XLogP1.94
TPSA68.54 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds1
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500211.22
LogP ≤ 51.94
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

tert-butyl (2R)-2-(furan-3-carbonylamino)propanoate
CID 81003529
tert-butyl N-(4-methoxybenzoyl)carbamate
CID 14221825
N-carbamoylfuran-3-carboxamide
CID 54444166
N-chlorofuran-3-carboxamide
CID 144607311
tert-butyl N-(furan-3-ylmethyl)carbamate
CID 45091890
N-methoxyfuran-3-carboxamide
CID 60701103
tert-butyl 4-[(furan-3-carbonylamino)carbamoyl]piperidine-1-carboxylate
CID 49042732
tert-butyl 4-[(2S)-2-(furan-3-carbonylamino)propanoyl]piperazine-1-carboxylate
CID 51963673
N-(2-methylbut-3-yn-2-yl)furan-3-carboxamide
CID 63998131
tert-butyl N-(2-chlorobenzoyl)carbamate
CID 140878254
tert-butyl N-(1-phenylethenyl)carbamate
CID 24881759
N-(4-hydroxy-2-methylbutan-2-yl)furan-3-carboxamide
CID 115869863

Frequently Asked Questions

What is the IUPAC name of tert-butyl N-(furan-3-carbonyl)carbamate?
The IUPAC name of tert-butyl N-(furan-3-carbonyl)carbamate (CID 176560288) is tert-butyl N-(furan-3-carbonyl)carbamate.
What is the SMILES notation for tert-butyl N-(furan-3-carbonyl)carbamate?
The canonical SMILES for tert-butyl N-(furan-3-carbonyl)carbamate is CC(C)(C)OC(=O)NC(=O)c1ccoc1.
What is the InChIKey of tert-butyl N-(furan-3-carbonyl)carbamate?
The InChIKey is HZZOBWVBKJMDJB-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H13NO4/c1-10(2,3)15-9(13)11-8(12)7-4-5-14-6-7/h4-6H,1-3H3,(H,11,12,13).
What are the key properties of tert-butyl N-(furan-3-carbonyl)carbamate?
tert-butyl N-(furan-3-carbonyl)carbamate has a molecular weight of 211.22 g/mol, XLogP of 1.94, 1 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for tert-butyl N-(furan-3-carbonyl)carbamate is sourced from PubChem (CID 176560288), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).