(3,4-diphenylfuran-2-yl)urea

C17H14N2O2 — CID 54111633

IUPAC(3,4-diphenylfuran-2-yl)urea
SMILESNC(=O)Nc1occ(-c2ccccc2)c1-c1ccccc1
InChIInChI=1S/C17H14N2O2/c18-17(20)19-16-15(13-9-5-2-6-10-13)14(11-21-16)12-7-3-1-4-8-12/h1-11H,(H3,18,19,20)
InChIKeyBGAPIGYITRRRPS-UHFFFAOYSA-N
MW278.31 g/mol
LogP4.10
Rot. Bonds3

About (3,4-diphenylfuran-2-yl)urea

(3,4-diphenylfuran-2-yl)urea (PubChem CID 54111633) has the molecular formula C17H14N2O2 and a molecular weight of 278.31 g/mol. Its IUPAC name is (3,4-diphenylfuran-2-yl)urea.

Molecular Properties

Compound Name(3,4-diphenylfuran-2-yl)urea
PubChem CID54111633
Molecular FormulaC17H14N2O2
Molecular Weight278.31 g/mol
Exact Mass278.11
IUPAC Name(3,4-diphenylfuran-2-yl)urea
SMILESNC(=O)Nc1occ(-c2ccccc2)c1-c1ccccc1
InChIInChI=1S/C17H14N2O2/c18-17(20)19-16-15(13-9-5-2-6-10-13)14(11-21-16)12-7-3-1-4-8-12/h1-11H,(H3,18,19,20)
InChIKeyBGAPIGYITRRRPS-UHFFFAOYSA-N
XLogP4.10
TPSA68.26 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms21
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500278.31
LogP ≤ 54.10
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of (3,4-diphenylfuran-2-yl)urea?
The IUPAC name of (3,4-diphenylfuran-2-yl)urea (CID 54111633) is (3,4-diphenylfuran-2-yl)urea.
What is the SMILES notation for (3,4-diphenylfuran-2-yl)urea?
The canonical SMILES for (3,4-diphenylfuran-2-yl)urea is NC(=O)Nc1occ(-c2ccccc2)c1-c1ccccc1.
What is the InChIKey of (3,4-diphenylfuran-2-yl)urea?
The InChIKey is BGAPIGYITRRRPS-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H14N2O2/c18-17(20)19-16-15(13-9-5-2-6-10-13)14(11-21-16)12-7-3-1-4-8-12/h1-11H,(H3,18,19,20).
What are the key properties of (3,4-diphenylfuran-2-yl)urea?
(3,4-diphenylfuran-2-yl)urea has a molecular weight of 278.31 g/mol, XLogP of 4.10, 3 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for (3,4-diphenylfuran-2-yl)urea is sourced from PubChem (CID 54111633), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).