furan-2-ylmethyl N,N-diphenylcarbamate

C18H15NO3 — CID 4257643

IUPACfuran-2-ylmethyl N,N-diphenylcarbamate
SMILESO=C(OCc1ccco1)N(c1ccccc1)c1ccccc1
InChIInChI=1S/C18H15NO3/c20-18(22-14-17-12-7-13-21-17)19(15-8-3-1-4-9-15)16-10-5-2-6-11-16/h1-13H,14H2
InChIKeyWYNNOUSTYFVODQ-UHFFFAOYSA-N
MW293.32 g/mol
LogP4.75
Rot. Bonds4

About furan-2-ylmethyl N,N-diphenylcarbamate

furan-2-ylmethyl N,N-diphenylcarbamate (PubChem CID 4257643) has the molecular formula C18H15NO3 and a molecular weight of 293.32 g/mol. Its IUPAC name is furan-2-ylmethyl N,N-diphenylcarbamate.

Molecular Properties

Compound Namefuran-2-ylmethyl N,N-diphenylcarbamate
PubChem CID4257643
Molecular FormulaC18H15NO3
Molecular Weight293.32 g/mol
Exact Mass293.11
IUPAC Namefuran-2-ylmethyl N,N-diphenylcarbamate
SMILESO=C(OCc1ccco1)N(c1ccccc1)c1ccccc1
InChIInChI=1S/C18H15NO3/c20-18(22-14-17-12-7-13-21-17)19(15-8-3-1-4-9-15)16-10-5-2-6-11-16/h1-13H,14H2
InChIKeyWYNNOUSTYFVODQ-UHFFFAOYSA-N
XLogP4.75
TPSA42.68 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500293.32
LogP ≤ 54.75
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of furan-2-ylmethyl N,N-diphenylcarbamate?
The IUPAC name of furan-2-ylmethyl N,N-diphenylcarbamate (CID 4257643) is furan-2-ylmethyl N,N-diphenylcarbamate.
What is the SMILES notation for furan-2-ylmethyl N,N-diphenylcarbamate?
The canonical SMILES for furan-2-ylmethyl N,N-diphenylcarbamate is O=C(OCc1ccco1)N(c1ccccc1)c1ccccc1.
What is the InChIKey of furan-2-ylmethyl N,N-diphenylcarbamate?
The InChIKey is WYNNOUSTYFVODQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H15NO3/c20-18(22-14-17-12-7-13-21-17)19(15-8-3-1-4-9-15)16-10-5-2-6-11-16/h1-13H,14H2.
What are the key properties of furan-2-ylmethyl N,N-diphenylcarbamate?
furan-2-ylmethyl N,N-diphenylcarbamate has a molecular weight of 293.32 g/mol, XLogP of 4.75, 4 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for furan-2-ylmethyl N,N-diphenylcarbamate is sourced from PubChem (CID 4257643), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).