N,N-dimethyl-5-oxo-2,2-diphenylfuran-3-carboxamide

C19H17NO3 — CID 67718012

IUPACN,N-dimethyl-5-oxo-2,2-diphenylfuran-3-carboxamide
SMILESCN(C)C(=O)C1=CC(=O)OC1(c1ccccc1)c1ccccc1
InChIInChI=1S/C19H17NO3/c1-20(2)18(22)16-13-17(21)23-19(16,14-9-5-3-6-10-14)15-11-7-4-8-12-15/h3-13H,1-2H3
InChIKeyAVLIVQLNZYRACO-UHFFFAOYSA-N
MW307.35 g/mol
LogP2.50
Rot. Bonds3

About N,N-dimethyl-5-oxo-2,2-diphenylfuran-3-carboxamide

N,N-dimethyl-5-oxo-2,2-diphenylfuran-3-carboxamide (PubChem CID 67718012) has the molecular formula C19H17NO3 and a molecular weight of 307.35 g/mol. Its IUPAC name is N,N-dimethyl-5-oxo-2,2-diphenylfuran-3-carboxamide.

Molecular Properties

Compound NameN,N-dimethyl-5-oxo-2,2-diphenylfuran-3-carboxamide
PubChem CID67718012
Molecular FormulaC19H17NO3
Molecular Weight307.35 g/mol
Exact Mass307.12
IUPAC NameN,N-dimethyl-5-oxo-2,2-diphenylfuran-3-carboxamide
SMILESCN(C)C(=O)C1=CC(=O)OC1(c1ccccc1)c1ccccc1
InChIInChI=1S/C19H17NO3/c1-20(2)18(22)16-13-17(21)23-19(16,14-9-5-3-6-10-14)15-11-7-4-8-12-15/h3-13H,1-2H3
InChIKeyAVLIVQLNZYRACO-UHFFFAOYSA-N
XLogP2.50
TPSA46.61 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500307.35
LogP ≤ 52.50
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of N,N-dimethyl-5-oxo-2,2-diphenylfuran-3-carboxamide?
The IUPAC name of N,N-dimethyl-5-oxo-2,2-diphenylfuran-3-carboxamide (CID 67718012) is N,N-dimethyl-5-oxo-2,2-diphenylfuran-3-carboxamide.
What is the SMILES notation for N,N-dimethyl-5-oxo-2,2-diphenylfuran-3-carboxamide?
The canonical SMILES for N,N-dimethyl-5-oxo-2,2-diphenylfuran-3-carboxamide is CN(C)C(=O)C1=CC(=O)OC1(c1ccccc1)c1ccccc1.
What is the InChIKey of N,N-dimethyl-5-oxo-2,2-diphenylfuran-3-carboxamide?
The InChIKey is AVLIVQLNZYRACO-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H17NO3/c1-20(2)18(22)16-13-17(21)23-19(16,14-9-5-3-6-10-14)15-11-7-4-8-12-15/h3-13H,1-2H3.
What are the key properties of N,N-dimethyl-5-oxo-2,2-diphenylfuran-3-carboxamide?
N,N-dimethyl-5-oxo-2,2-diphenylfuran-3-carboxamide has a molecular weight of 307.35 g/mol, XLogP of 2.50, 3 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N,N-dimethyl-5-oxo-2,2-diphenylfuran-3-carboxamide is sourced from PubChem (CID 67718012), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).