N-(3,3-diphenylpropyl)-2,5-dimethylfuran-3-carboxamide

C22H23NO2 — CID 4879946

IUPACN-(3,3-diphenylpropyl)-2,5-dimethylfuran-3-carboxamide
SMILESCc1cc(C(=O)NCCC(c2ccccc2)c2ccccc2)c(C)o1
InChIInChI=1S/C22H23NO2/c1-16-15-21(17(2)25-16)22(24)23-14-13-20(18-9-5-3-6-10-18)19-11-7-4-8-12-19/h3-12,15,20H,13-14H2,1-2H3,(H,23,24)
InChIKeyMBQNDFJOGOCHND-UHFFFAOYSA-N
MW333.43 g/mol
LogP4.85
Rot. Bonds6

About N-(3,3-diphenylpropyl)-2,5-dimethylfuran-3-carboxamide

N-(3,3-diphenylpropyl)-2,5-dimethylfuran-3-carboxamide (PubChem CID 4879946) has the molecular formula C22H23NO2 and a molecular weight of 333.43 g/mol. Its IUPAC name is N-(3,3-diphenylpropyl)-2,5-dimethylfuran-3-carboxamide.

Molecular Properties

Compound NameN-(3,3-diphenylpropyl)-2,5-dimethylfuran-3-carboxamide
PubChem CID4879946
Molecular FormulaC22H23NO2
Molecular Weight333.43 g/mol
Exact Mass333.17
IUPAC NameN-(3,3-diphenylpropyl)-2,5-dimethylfuran-3-carboxamide
SMILESCc1cc(C(=O)NCCC(c2ccccc2)c2ccccc2)c(C)o1
InChIInChI=1S/C22H23NO2/c1-16-15-21(17(2)25-16)22(24)23-14-13-20(18-9-5-3-6-10-18)19-11-7-4-8-12-19/h3-12,15,20H,13-14H2,1-2H3,(H,23,24)
InChIKeyMBQNDFJOGOCHND-UHFFFAOYSA-N
XLogP4.85
TPSA42.24 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds6
Heavy Atoms25
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500333.43
LogP ≤ 54.85
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

[3-(3-carbamoyl-5-methylfuran-2-yl)phenyl] N-(6-phenylhexyl)carbamate
CID 46916519
3-(5-methyl-2-furyl)-N-(2-phenylethyl)acrylamide
CID 874587
4-[(5-Isobutyl-2-methyl-furan-3-carbonyl)-amino]-butyric acid
CID 2932477
3-furyl-[(3S,4S)-3-phenyl-4-[(4-phenyl-1-piperidyl)methyl]pyrrolidin-1-yl]methanone
CID 489823
N-Benzyl-3-(5-methyl-furan-2-yl)-propionamide
CID 827173
(4-Benzylpiperidin-1-yl)-(2,5-dimethylfuran-3-yl)methanone
CID 1245621
(2,5-Dimethylfuran-3-yl)-(3,5-dimethylpiperidin-1-yl)methanone
CID 4573434
N-[2-(3,4-dimethoxyphenyl)ethyl]-2,5-dimethylfuran-3-carboxamide
CID 4788144
3,4-dihydro-1H-isoquinolin-2-yl-(2,5-dimethylfuran-3-yl)methanone
CID 18108187
N-benzyl-2-methylfuran-3-carboxamide
CID 690372
2-methyl-N-[[3-[[(2-methylfuran-3-carbonyl)amino]methyl]phenyl]methyl]furan-3-carboxamide
CID 1292163
1-(Diphenylmethyl)-4-(2-methyl-3-furoyl)piperazine
CID 1293145

Frequently Asked Questions

What is the IUPAC name of N-(3,3-diphenylpropyl)-2,5-dimethylfuran-3-carboxamide?
The IUPAC name of N-(3,3-diphenylpropyl)-2,5-dimethylfuran-3-carboxamide (CID 4879946) is N-(3,3-diphenylpropyl)-2,5-dimethylfuran-3-carboxamide.
What is the SMILES notation for N-(3,3-diphenylpropyl)-2,5-dimethylfuran-3-carboxamide?
The canonical SMILES for N-(3,3-diphenylpropyl)-2,5-dimethylfuran-3-carboxamide is Cc1cc(C(=O)NCCC(c2ccccc2)c2ccccc2)c(C)o1.
What is the InChIKey of N-(3,3-diphenylpropyl)-2,5-dimethylfuran-3-carboxamide?
The InChIKey is MBQNDFJOGOCHND-UHFFFAOYSA-N. The full InChI is InChI=1S/C22H23NO2/c1-16-15-21(17(2)25-16)22(24)23-14-13-20(18-9-5-3-6-10-18)19-11-7-4-8-12-19/h3-12,15,20H,13-14H2,1-2H3,(H,23,24).
What are the key properties of N-(3,3-diphenylpropyl)-2,5-dimethylfuran-3-carboxamide?
N-(3,3-diphenylpropyl)-2,5-dimethylfuran-3-carboxamide has a molecular weight of 333.43 g/mol, XLogP of 4.85, 6 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-(3,3-diphenylpropyl)-2,5-dimethylfuran-3-carboxamide is sourced from PubChem (CID 4879946), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).