N-[2-(dimethylamino)-2-(furan-2-yl)ethyl]-2-[(4-fluorophenyl)methoxy]benzamide

C22H23FN2O3 — CID 55332202

IUPACN-[2-(dimethylamino)-2-(furan-2-yl)ethyl]-2-[(4-fluorophenyl)methoxy]benzamide
SMILESCN(C)C(CNC(=O)c1ccccc1OCc1ccc(F)cc1)c1ccco1
InChIInChI=1S/C22H23FN2O3/c1-25(2)19(21-8-5-13-27-21)14-24-22(26)18-6-3-4-7-20(18)28-15-16-9-11-17(23)12-10-16/h3-13,19H,14-15H2,1-2H3,(H,24,26)
InChIKeyPDESJVVUOYQWHT-UHFFFAOYSA-N
MW382.44 g/mol
LogP4.03
Rot. Bonds8

About N-[2-(dimethylamino)-2-(furan-2-yl)ethyl]-2-[(4-fluorophenyl)methoxy]benzamide

N-[2-(dimethylamino)-2-(furan-2-yl)ethyl]-2-[(4-fluorophenyl)methoxy]benzamide (PubChem CID 55332202) has the molecular formula C22H23FN2O3 and a molecular weight of 382.44 g/mol. Its IUPAC name is N-[2-(dimethylamino)-2-(furan-2-yl)ethyl]-2-[(4-fluorophenyl)methoxy]benzamide.

Molecular Properties

Compound NameN-[2-(dimethylamino)-2-(furan-2-yl)ethyl]-2-[(4-fluorophenyl)methoxy]benzamide
PubChem CID55332202
Molecular FormulaC22H23FN2O3
Molecular Weight382.44 g/mol
Exact Mass382.17
IUPAC NameN-[2-(dimethylamino)-2-(furan-2-yl)ethyl]-2-[(4-fluorophenyl)methoxy]benzamide
SMILESCN(C)C(CNC(=O)c1ccccc1OCc1ccc(F)cc1)c1ccco1
InChIInChI=1S/C22H23FN2O3/c1-25(2)19(21-8-5-13-27-21)14-24-22(26)18-6-3-4-7-20(18)28-15-16-9-11-17(23)12-10-16/h3-13,19H,14-15H2,1-2H3,(H,24,26)
InChIKeyPDESJVVUOYQWHT-UHFFFAOYSA-N
XLogP4.03
TPSA54.71 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds8
Heavy Atoms28
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500382.44
LogP ≤ 54.03
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

N-[2-(dimethylamino)-2-(furan-2-yl)ethyl]-2-(4-fluorophenyl)acetamide
CID 18588939
N-[2-(dimethylamino)-2-(furan-2-yl)ethyl]-4-fluorobenzamide;hydrochloride
CID 52985207
N-[2-(dimethylamino)-2-(furan-2-yl)ethyl]-2-methylsulfanylbenzamide
CID 4878728
N-[(2R)-2-(dimethylamino)-2-(furan-2-yl)ethyl]-2-methylbenzamide
CID 26818992
2-[(4-fluorophenyl)methoxy]-N-[2-(methylamino)propyl]benzamide;hydrochloride
CID 120833129
N-[2-(dimethylamino)-2-(furan-2-yl)ethyl]-2-fluoro-3-methylbenzamide
CID 80710543
N-[2-[[2-(dimethylamino)-2-(furan-2-yl)ethyl]amino]-2-oxoethyl]-2-fluorobenzamide
CID 51162690
1-[2-(dimethylamino)-2-(furan-2-yl)ethyl]-3-(4-fluorophenyl)urea
CID 17494246
N-[2-(dimethylamino)-2-(furan-2-yl)ethyl]-2,3-dimethylbenzamide
CID 51162753
N-[2-(dimethylamino)-2-(furan-2-yl)ethyl]benzamide;hydrochloride
CID 20994951
N-[2-(dimethylamino)-2-(furan-2-yl)ethyl]-2-(1H-imidazol-2-yl)benzamide
CID 74242160
N-(2-amino-2-methylpropyl)-2-[(4-fluorophenyl)methoxy]benzamide;hydrochloride
CID 119626985

Frequently Asked Questions

What is the IUPAC name of N-[2-(dimethylamino)-2-(furan-2-yl)ethyl]-2-[(4-fluorophenyl)methoxy]benzamide?
The IUPAC name of N-[2-(dimethylamino)-2-(furan-2-yl)ethyl]-2-[(4-fluorophenyl)methoxy]benzamide (CID 55332202) is N-[2-(dimethylamino)-2-(furan-2-yl)ethyl]-2-[(4-fluorophenyl)methoxy]benzamide.
What is the SMILES notation for N-[2-(dimethylamino)-2-(furan-2-yl)ethyl]-2-[(4-fluorophenyl)methoxy]benzamide?
The canonical SMILES for N-[2-(dimethylamino)-2-(furan-2-yl)ethyl]-2-[(4-fluorophenyl)methoxy]benzamide is CN(C)C(CNC(=O)c1ccccc1OCc1ccc(F)cc1)c1ccco1.
What is the InChIKey of N-[2-(dimethylamino)-2-(furan-2-yl)ethyl]-2-[(4-fluorophenyl)methoxy]benzamide?
The InChIKey is PDESJVVUOYQWHT-UHFFFAOYSA-N. The full InChI is InChI=1S/C22H23FN2O3/c1-25(2)19(21-8-5-13-27-21)14-24-22(26)18-6-3-4-7-20(18)28-15-16-9-11-17(23)12-10-16/h3-13,19H,14-15H2,1-2H3,(H,24,26).
What are the key properties of N-[2-(dimethylamino)-2-(furan-2-yl)ethyl]-2-[(4-fluorophenyl)methoxy]benzamide?
N-[2-(dimethylamino)-2-(furan-2-yl)ethyl]-2-[(4-fluorophenyl)methoxy]benzamide has a molecular weight of 382.44 g/mol, XLogP of 4.03, 8 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-[2-(dimethylamino)-2-(furan-2-yl)ethyl]-2-[(4-fluorophenyl)methoxy]benzamide is sourced from PubChem (CID 55332202), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).