methyl N-(furan-3-yl)carbamate

C6H7NO3 — CID 12963185

IUPACmethyl N-(furan-3-yl)carbamate
SMILESCOC(=O)Nc1ccoc1
InChIInChI=1S/C6H7NO3/c1-9-6(8)7-5-2-3-10-4-5/h2-4H,1H3,(H,7,8)
InChIKeyDCTSNXNLHMHQMG-UHFFFAOYSA-N
MW141.13 g/mol
LogP1.46
Rot. Bonds1

About methyl N-(furan-3-yl)carbamate

methyl N-(furan-3-yl)carbamate (PubChem CID 12963185) has the molecular formula C6H7NO3 and a molecular weight of 141.13 g/mol. Its IUPAC name is methyl N-(furan-3-yl)carbamate.

Molecular Properties

Compound Namemethyl N-(furan-3-yl)carbamate
PubChem CID12963185
Molecular FormulaC6H7NO3
Molecular Weight141.13 g/mol
Exact Mass141.04
IUPAC Namemethyl N-(furan-3-yl)carbamate
SMILESCOC(=O)Nc1ccoc1
InChIInChI=1S/C6H7NO3/c1-9-6(8)7-5-2-3-10-4-5/h2-4H,1H3,(H,7,8)
InChIKeyDCTSNXNLHMHQMG-UHFFFAOYSA-N
XLogP1.46
TPSA51.47 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds1
Heavy Atoms10
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500141.13
LogP ≤ 51.46
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

tert-butyl N-(furan-3-yl)carbamate
CID 12207186
3-Acetamidofuran
CID 521882
Ammonium, (3-furyl)trimethyl-, iodide
CID 199990
3-Furanamine
CID 19962876
3-Furylalanine
CID 22875442
3-Furylaminobutyric acid
CID 68798095
3-Furylurea
CID 101076529
Furan-3-yl(trimethyl)azanium
CID 199991
N-(2-fluoroethyl)furan-3-amine
CID 140143628
N-(2,2-difluoroethyl)furan-3-amine
CID 151412690
N-(furan-3-yl)pent-4-enamide
CID 11105709
Tert-butyl 2-bromofuran-3-ylcarbamate
CID 53420002

Frequently Asked Questions

What is the IUPAC name of methyl N-(furan-3-yl)carbamate?
The IUPAC name of methyl N-(furan-3-yl)carbamate (CID 12963185) is methyl N-(furan-3-yl)carbamate.
What is the SMILES notation for methyl N-(furan-3-yl)carbamate?
The canonical SMILES for methyl N-(furan-3-yl)carbamate is COC(=O)Nc1ccoc1.
What is the InChIKey of methyl N-(furan-3-yl)carbamate?
The InChIKey is DCTSNXNLHMHQMG-UHFFFAOYSA-N. The full InChI is InChI=1S/C6H7NO3/c1-9-6(8)7-5-2-3-10-4-5/h2-4H,1H3,(H,7,8).
What are the key properties of methyl N-(furan-3-yl)carbamate?
methyl N-(furan-3-yl)carbamate has a molecular weight of 141.13 g/mol, XLogP of 1.46, 1 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for methyl N-(furan-3-yl)carbamate is sourced from PubChem (CID 12963185), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).