N-ethyl-4-fluoro-3-methyl-N-(2-phenylethyl)benzamide

C18H20FNO — CID 63213317

IUPACN-ethyl-4-fluoro-3-methyl-N-(2-phenylethyl)benzamide
SMILESCCN(CCc1ccccc1)C(=O)c1ccc(F)c(C)c1
InChIInChI=1S/C18H20FNO/c1-3-20(12-11-15-7-5-4-6-8-15)18(21)16-9-10-17(19)14(2)13-16/h4-10,13H,3,11-12H2,1-2H3
InChIKeyCQZWUJVIXIROHF-UHFFFAOYSA-N
MW285.36 g/mol
LogP3.84
Rot. Bonds5

About N-ethyl-4-fluoro-3-methyl-N-(2-phenylethyl)benzamide

N-ethyl-4-fluoro-3-methyl-N-(2-phenylethyl)benzamide (PubChem CID 63213317) has the molecular formula C18H20FNO and a molecular weight of 285.36 g/mol. Its IUPAC name is N-ethyl-4-fluoro-3-methyl-N-(2-phenylethyl)benzamide.

Molecular Properties

Compound NameN-ethyl-4-fluoro-3-methyl-N-(2-phenylethyl)benzamide
PubChem CID63213317
Molecular FormulaC18H20FNO
Molecular Weight285.36 g/mol
Exact Mass285.15
IUPAC NameN-ethyl-4-fluoro-3-methyl-N-(2-phenylethyl)benzamide
SMILESCCN(CCc1ccccc1)C(=O)c1ccc(F)c(C)c1
InChIInChI=1S/C18H20FNO/c1-3-20(12-11-15-7-5-4-6-8-15)18(21)16-9-10-17(19)14(2)13-16/h4-10,13H,3,11-12H2,1-2H3
InChIKeyCQZWUJVIXIROHF-UHFFFAOYSA-N
XLogP3.84
TPSA20.31 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds5
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500285.36
LogP ≤ 53.84
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

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Related Compounds

3-amino-N-ethyl-4-fluoro-N-(2-phenylethyl)benzamide
CID 61108530
N-(2-ethoxyethyl)-N-ethyl-4-fluoro-3-methylbenzamide
CID 63692679
4-fluoro-3-methyl-N,N-dipropylbenzamide
CID 63212171
4-N-(2-aminoethyl)-1-N-ethyl-4-N-(2-phenylethyl)-1-N-propylbenzene-1,4-dicarboxamide
CID 120884506
2-chloro-N-ethyl-N-(2-phenylethyl)pyridine-4-carboxamide
CID 60738878
3-acetamido-N-(2-aminoethyl)-4-fluoro-N-(2-phenylethyl)benzamide
CID 120884910
N-(2-bromoethyl)-4-fluoro-3-methyl-N-propylbenzamide
CID 80660124
N-ethyl-5-iodo-N-(2-phenylethyl)thiophene-3-carboxamide
CID 78948452
4-(dimethylsulfamoyl)-N-ethyl-N-(2-phenylethyl)benzamide
CID 55588043
N-ethyl-4-fluoro-3-methyl-N-[2-oxo-2-(propan-2-ylamino)ethyl]benzamide
CID 63212665
2-amino-N-ethyl-3-fluoro-N-(2-phenylethyl)benzamide
CID 81499615
N-(2-aminoethyl)-3-methyl-4-nitro-N-(2-phenylethyl)benzamide
CID 120887038

Frequently Asked Questions

What is the IUPAC name of N-ethyl-4-fluoro-3-methyl-N-(2-phenylethyl)benzamide?
The IUPAC name of N-ethyl-4-fluoro-3-methyl-N-(2-phenylethyl)benzamide (CID 63213317) is N-ethyl-4-fluoro-3-methyl-N-(2-phenylethyl)benzamide.
What is the SMILES notation for N-ethyl-4-fluoro-3-methyl-N-(2-phenylethyl)benzamide?
The canonical SMILES for N-ethyl-4-fluoro-3-methyl-N-(2-phenylethyl)benzamide is CCN(CCc1ccccc1)C(=O)c1ccc(F)c(C)c1.
What is the InChIKey of N-ethyl-4-fluoro-3-methyl-N-(2-phenylethyl)benzamide?
The InChIKey is CQZWUJVIXIROHF-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H20FNO/c1-3-20(12-11-15-7-5-4-6-8-15)18(21)16-9-10-17(19)14(2)13-16/h4-10,13H,3,11-12H2,1-2H3.
What are the key properties of N-ethyl-4-fluoro-3-methyl-N-(2-phenylethyl)benzamide?
N-ethyl-4-fluoro-3-methyl-N-(2-phenylethyl)benzamide has a molecular weight of 285.36 g/mol, XLogP of 3.84, 5 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for N-ethyl-4-fluoro-3-methyl-N-(2-phenylethyl)benzamide is sourced from PubChem (CID 63213317), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).