N-benzyl-2-(3,4-dichlorophenyl)-4-ethenyl-2,5-dihydrofuran-3-carboxamide

C20H17Cl2NO2 — CID 57328629

IUPACN-benzyl-2-(3,4-dichlorophenyl)-4-ethenyl-2,5-dihydrofuran-3-carboxamide
SMILESC=CC1=C(C(=O)NCc2ccccc2)C(c2ccc(Cl)c(Cl)c2)OC1
InChIInChI=1S/C20H17Cl2NO2/c1-2-14-12-25-19(15-8-9-16(21)17(22)10-15)18(14)20(24)23-11-13-6-4-3-5-7-13/h2-10,19H,1,11-12H2,(H,23,24)
InChIKeyPVAMLSXYCKMQTO-UHFFFAOYSA-N
MW374.27 g/mol
LogP4.86
Rot. Bonds5

About N-benzyl-2-(3,4-dichlorophenyl)-4-ethenyl-2,5-dihydrofuran-3-carboxamide

N-benzyl-2-(3,4-dichlorophenyl)-4-ethenyl-2,5-dihydrofuran-3-carboxamide (PubChem CID 57328629) has the molecular formula C20H17Cl2NO2 and a molecular weight of 374.27 g/mol. Its IUPAC name is N-benzyl-2-(3,4-dichlorophenyl)-4-ethenyl-2,5-dihydrofuran-3-carboxamide.

Molecular Properties

Compound NameN-benzyl-2-(3,4-dichlorophenyl)-4-ethenyl-2,5-dihydrofuran-3-carboxamide
PubChem CID57328629
Molecular FormulaC20H17Cl2NO2
Molecular Weight374.27 g/mol
Exact Mass373.06
IUPAC NameN-benzyl-2-(3,4-dichlorophenyl)-4-ethenyl-2,5-dihydrofuran-3-carboxamide
SMILESC=CC1=C(C(=O)NCc2ccccc2)C(c2ccc(Cl)c(Cl)c2)OC1
InChIInChI=1S/C20H17Cl2NO2/c1-2-14-12-25-19(15-8-9-16(21)17(22)10-15)18(14)20(24)23-11-13-6-4-3-5-7-13/h2-10,19H,1,11-12H2,(H,23,24)
InChIKeyPVAMLSXYCKMQTO-UHFFFAOYSA-N
XLogP4.86
TPSA38.33 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds5
Heavy Atoms25
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500374.27
LogP ≤ 54.86
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

N-[(4-chlorophenyl)methyl]-4-ethenyl-2-(4-fluorophenyl)-2,5-dihydrofuran-3-carboxamide
CID 57328484
2-(3,4-dichlorophenyl)-4-ethenyl-N-phenyl-2,5-dihydrofuran-3-carboxamide
CID 57328562
2-(3,4-dichlorophenyl)-4-ethenyl-N-propyl-2,5-dihydrofuran-3-carboxamide
CID 57328630
2-(3,4-dichlorophenyl)-4-ethenyl-N-pentyl-2,5-dihydrofuran-3-carboxamide
CID 57328631
2-(3,4-dichlorophenyl)-4-ethenyl-N-(2-methylpropyl)-2,5-dihydrofuran-3-carboxamide
CID 57328632
N-tert-butyl-2-(3,4-dichlorophenyl)-4-ethenyl-2,5-dihydrofuran-3-carboxamide
CID 57328633
N-[(1R,2S)-2-[(3,4-dichlorophenyl)methoxy]cyclohexyl]-3,4-difluorobenzamide
CID 90644974
3,4-dichloro-N-(2-(2-phenylmorpholino)ethyl)benzamide
CID 16892437
(3,4-Dichlorophenyl)(2-phenylmorpholino)methanone
CID 16894689
N-[(2S*,4R*,6S*)-2-(4-chlorophenyl)-6-ethyltetrahydro-2H-pyran-4-yl]benzamide
CID 50984348
N-[[4-[(3,4-dichlorophenyl)methyl]morpholin-2-yl]methyl]-2-[2-(4-fluorophenyl)-5-methyl-3H-1,3-oxazol-2-yl]acetamide
CID 69611370
(2R,3S)-N-benzyl-2-(3-chloro-5-fluorophenyl)-3-phenylmethoxypent-4-enamide
CID 164579289

Frequently Asked Questions

What is the IUPAC name of N-benzyl-2-(3,4-dichlorophenyl)-4-ethenyl-2,5-dihydrofuran-3-carboxamide?
The IUPAC name of N-benzyl-2-(3,4-dichlorophenyl)-4-ethenyl-2,5-dihydrofuran-3-carboxamide (CID 57328629) is N-benzyl-2-(3,4-dichlorophenyl)-4-ethenyl-2,5-dihydrofuran-3-carboxamide.
What is the SMILES notation for N-benzyl-2-(3,4-dichlorophenyl)-4-ethenyl-2,5-dihydrofuran-3-carboxamide?
The canonical SMILES for N-benzyl-2-(3,4-dichlorophenyl)-4-ethenyl-2,5-dihydrofuran-3-carboxamide is C=CC1=C(C(=O)NCc2ccccc2)C(c2ccc(Cl)c(Cl)c2)OC1.
What is the InChIKey of N-benzyl-2-(3,4-dichlorophenyl)-4-ethenyl-2,5-dihydrofuran-3-carboxamide?
The InChIKey is PVAMLSXYCKMQTO-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H17Cl2NO2/c1-2-14-12-25-19(15-8-9-16(21)17(22)10-15)18(14)20(24)23-11-13-6-4-3-5-7-13/h2-10,19H,1,11-12H2,(H,23,24).
What are the key properties of N-benzyl-2-(3,4-dichlorophenyl)-4-ethenyl-2,5-dihydrofuran-3-carboxamide?
N-benzyl-2-(3,4-dichlorophenyl)-4-ethenyl-2,5-dihydrofuran-3-carboxamide has a molecular weight of 374.27 g/mol, XLogP of 4.86, 5 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-benzyl-2-(3,4-dichlorophenyl)-4-ethenyl-2,5-dihydrofuran-3-carboxamide is sourced from PubChem (CID 57328629), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).