N-[2-(4-chlorophenyl)-2-(diethylamino)ethyl]-2-fluorobenzamide

C19H22ClFN2O — CID 112503768

IUPACN-[2-(4-chlorophenyl)-2-(diethylamino)ethyl]-2-fluorobenzamide
SMILESCCN(CC)C(CNC(=O)c1ccccc1F)c1ccc(Cl)cc1
InChIInChI=1S/C19H22ClFN2O/c1-3-23(4-2)18(14-9-11-15(20)12-10-14)13-22-19(24)16-7-5-6-8-17(16)21/h5-12,18H,3-4,13H2,1-2H3,(H,22,24)
InChIKeyQSOPHFQKPMDWGA-UHFFFAOYSA-N
MW348.85 g/mol
LogP4.29
Rot. Bonds7

About N-[2-(4-chlorophenyl)-2-(diethylamino)ethyl]-2-fluorobenzamide

N-[2-(4-chlorophenyl)-2-(diethylamino)ethyl]-2-fluorobenzamide (PubChem CID 112503768) has the molecular formula C19H22ClFN2O and a molecular weight of 348.85 g/mol. Its IUPAC name is N-[2-(4-chlorophenyl)-2-(diethylamino)ethyl]-2-fluorobenzamide.

Molecular Properties

Compound NameN-[2-(4-chlorophenyl)-2-(diethylamino)ethyl]-2-fluorobenzamide
PubChem CID112503768
Molecular FormulaC19H22ClFN2O
Molecular Weight348.85 g/mol
Exact Mass348.14
IUPAC NameN-[2-(4-chlorophenyl)-2-(diethylamino)ethyl]-2-fluorobenzamide
SMILESCCN(CC)C(CNC(=O)c1ccccc1F)c1ccc(Cl)cc1
InChIInChI=1S/C19H22ClFN2O/c1-3-23(4-2)18(14-9-11-15(20)12-10-14)13-22-19(24)16-7-5-6-8-17(16)21/h5-12,18H,3-4,13H2,1-2H3,(H,22,24)
InChIKeyQSOPHFQKPMDWGA-UHFFFAOYSA-N
XLogP4.29
TPSA32.34 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds7
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500348.85
LogP ≤ 54.29
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

4-bromo-N-[2-(diethylamino)-2-phenylethyl]-2-fluorobenzamide
CID 18167188
N-[2-(diethylamino)-2-phenylethyl]-2-methylsulfanylbenzamide
CID 18167069
2-bromo-N-[2-(4-chlorophenyl)-2-(dimethylamino)ethyl]benzamide
CID 112503708
N-[2-(diethylamino)-2-phenylethyl]-4-(2-fluorophenyl)-4-oxobutanamide
CID 110622036
2-fluoro-N-(2-hydroxypropyl)benzamide
CID 43391205
3-[(2-fluorobenzoyl)amino]-2-phenylpropanoic acid
CID 62882788
N-[2-(dimethylamino)-2-thiophen-2-ylethyl]-2-fluorobenzamide
CID 18161749
N-[(2S)-2-(diethylamino)-2-phenylethyl]-2-sulfanylidene-1H-pyridine-3-carboxamide
CID 25482491
4-amino-5-chloro-N-[2-(diethylamino)-2-phenylethyl]-2-methoxybenzamide
CID 119399247
N-[2-(diethylamino)-2-phenylethyl]-1-methyl-3-(trifluoromethyl)pyrazole-4-carboxamide
CID 87008611
2-chloro-N-[2-(diethylamino)-2-thiophen-2-ylethyl]-6-fluorobenzamide
CID 112503956
N-[2-(4-chlorophenyl)ethyl]-2-fluorobenzamide
CID 673830

Frequently Asked Questions

What is the IUPAC name of N-[2-(4-chlorophenyl)-2-(diethylamino)ethyl]-2-fluorobenzamide?
The IUPAC name of N-[2-(4-chlorophenyl)-2-(diethylamino)ethyl]-2-fluorobenzamide (CID 112503768) is N-[2-(4-chlorophenyl)-2-(diethylamino)ethyl]-2-fluorobenzamide.
What is the SMILES notation for N-[2-(4-chlorophenyl)-2-(diethylamino)ethyl]-2-fluorobenzamide?
The canonical SMILES for N-[2-(4-chlorophenyl)-2-(diethylamino)ethyl]-2-fluorobenzamide is CCN(CC)C(CNC(=O)c1ccccc1F)c1ccc(Cl)cc1.
What is the InChIKey of N-[2-(4-chlorophenyl)-2-(diethylamino)ethyl]-2-fluorobenzamide?
The InChIKey is QSOPHFQKPMDWGA-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H22ClFN2O/c1-3-23(4-2)18(14-9-11-15(20)12-10-14)13-22-19(24)16-7-5-6-8-17(16)21/h5-12,18H,3-4,13H2,1-2H3,(H,22,24).
What are the key properties of N-[2-(4-chlorophenyl)-2-(diethylamino)ethyl]-2-fluorobenzamide?
N-[2-(4-chlorophenyl)-2-(diethylamino)ethyl]-2-fluorobenzamide has a molecular weight of 348.85 g/mol, XLogP of 4.29, 7 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-[2-(4-chlorophenyl)-2-(diethylamino)ethyl]-2-fluorobenzamide is sourced from PubChem (CID 112503768), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).