N,N-diethyl-5-methyl-2,2-diphenyl-3H-furan-4-carboxamide

C22H25NO2 — CID 132934478

IUPACN,N-diethyl-5-methyl-2,2-diphenyl-3H-furan-4-carboxamide
SMILESCCN(CC)C(=O)C1=C(C)OC(c2ccccc2)(c2ccccc2)C1
InChIInChI=1S/C22H25NO2/c1-4-23(5-2)21(24)20-16-22(25-17(20)3,18-12-8-6-9-13-18)19-14-10-7-11-15-19/h6-15H,4-5,16H2,1-3H3
InChIKeyMVVVABWAWPBEND-UHFFFAOYSA-N
MW335.45 g/mol
LogP4.49
Rot. Bonds5

About N,N-diethyl-5-methyl-2,2-diphenyl-3H-furan-4-carboxamide

N,N-diethyl-5-methyl-2,2-diphenyl-3H-furan-4-carboxamide (PubChem CID 132934478) has the molecular formula C22H25NO2 and a molecular weight of 335.45 g/mol. Its IUPAC name is N,N-diethyl-5-methyl-2,2-diphenyl-3H-furan-4-carboxamide.

Molecular Properties

Compound NameN,N-diethyl-5-methyl-2,2-diphenyl-3H-furan-4-carboxamide
PubChem CID132934478
Molecular FormulaC22H25NO2
Molecular Weight335.45 g/mol
Exact Mass335.19
IUPAC NameN,N-diethyl-5-methyl-2,2-diphenyl-3H-furan-4-carboxamide
SMILESCCN(CC)C(=O)C1=C(C)OC(c2ccccc2)(c2ccccc2)C1
InChIInChI=1S/C22H25NO2/c1-4-23(5-2)21(24)20-16-22(25-17(20)3,18-12-8-6-9-13-18)19-14-10-7-11-15-19/h6-15H,4-5,16H2,1-3H3
InChIKeyMVVVABWAWPBEND-UHFFFAOYSA-N
XLogP4.49
TPSA29.54 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds5
Heavy Atoms25
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500335.45
LogP ≤ 54.49
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Related Compounds

2-(4-Benzyloxy-cyclohexa-1,3-dienyl)-N-methyl-N-phenethyl-acetamide
CID 44356239
5-Phenyl-3-(6-phenylhexanoyl)-1,3-oxazol-2-one
CID 162652378
3-Diethylaminomethyl-3,3-diphenyl-2-dihydrofuranone
CID 127417
4-[(2,4-Difluorophenyl)methoxy]-3-[(2,4-difluorophenyl)methyl]-6-methyl-1-prop-2-enylpyridin-2-one
CID 22050570
2-(4-fluorophenyl)-N,6-dimethyl-5-phenyl-3a,4-dihydro-1-benzofuran-3-carboxamide
CID 123235562
3-(Benzoyloxyphenylmethylene)-1-methylpiperidin-2-one
CID 129870838
3-Benzyl-2,6-dimethyl-2-phenyl-1,3-oxazin-4-one
CID 132969071
2,3-Dimethyl-11-methylidene-6,12-dihydro-[2]benzoxocino[4,3-c]pyridin-1-one
CID 135016118
N-tert-butyl-2,2-bis(4-fluorophenyl)-5-methyl-3H-furan-4-carboxamide
CID 11793579
1,3-dimethyl-6,6-diphenyl-5H-furo[2,3-d]pyrimidine-2,4-dione
CID 11450454
1,3-diethyl-6,6-diphenyl-2-sulfanylidene-5H-furo[2,3-d]pyrimidin-4-one
CID 21591778
5-benzyl-2,2-diphenyl-6,7-dihydro-3H-furo[3,2-c]pyridin-4-one
CID 101375308

Frequently Asked Questions

What is the IUPAC name of N,N-diethyl-5-methyl-2,2-diphenyl-3H-furan-4-carboxamide?
The IUPAC name of N,N-diethyl-5-methyl-2,2-diphenyl-3H-furan-4-carboxamide (CID 132934478) is N,N-diethyl-5-methyl-2,2-diphenyl-3H-furan-4-carboxamide.
What is the SMILES notation for N,N-diethyl-5-methyl-2,2-diphenyl-3H-furan-4-carboxamide?
The canonical SMILES for N,N-diethyl-5-methyl-2,2-diphenyl-3H-furan-4-carboxamide is CCN(CC)C(=O)C1=C(C)OC(c2ccccc2)(c2ccccc2)C1.
What is the InChIKey of N,N-diethyl-5-methyl-2,2-diphenyl-3H-furan-4-carboxamide?
The InChIKey is MVVVABWAWPBEND-UHFFFAOYSA-N. The full InChI is InChI=1S/C22H25NO2/c1-4-23(5-2)21(24)20-16-22(25-17(20)3,18-12-8-6-9-13-18)19-14-10-7-11-15-19/h6-15H,4-5,16H2,1-3H3.
What are the key properties of N,N-diethyl-5-methyl-2,2-diphenyl-3H-furan-4-carboxamide?
N,N-diethyl-5-methyl-2,2-diphenyl-3H-furan-4-carboxamide has a molecular weight of 335.45 g/mol, XLogP of 4.49, 5 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N,N-diethyl-5-methyl-2,2-diphenyl-3H-furan-4-carboxamide is sourced from PubChem (CID 132934478), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).