2-(ethylamino)-N-(4-fluoro-3-methylphenyl)-5-methylbenzamide

C17H19FN2O — CID 62813653

IUPAC2-(ethylamino)-N-(4-fluoro-3-methylphenyl)-5-methylbenzamide
SMILESCCNc1ccc(C)cc1C(=O)Nc1ccc(F)c(C)c1
InChIInChI=1S/C17H19FN2O/c1-4-19-16-8-5-11(2)9-14(16)17(21)20-13-6-7-15(18)12(3)10-13/h5-10,19H,4H2,1-3H3,(H,20,21)
InChIKeyZKJZUYHVWODBPE-UHFFFAOYSA-N
MW286.35 g/mol
LogP4.13
Rot. Bonds4

About 2-(ethylamino)-N-(4-fluoro-3-methylphenyl)-5-methylbenzamide

2-(ethylamino)-N-(4-fluoro-3-methylphenyl)-5-methylbenzamide (PubChem CID 62813653) has the molecular formula C17H19FN2O and a molecular weight of 286.35 g/mol. Its IUPAC name is 2-(ethylamino)-N-(4-fluoro-3-methylphenyl)-5-methylbenzamide.

Molecular Properties

Compound Name2-(ethylamino)-N-(4-fluoro-3-methylphenyl)-5-methylbenzamide
PubChem CID62813653
Molecular FormulaC17H19FN2O
Molecular Weight286.35 g/mol
Exact Mass286.15
IUPAC Name2-(ethylamino)-N-(4-fluoro-3-methylphenyl)-5-methylbenzamide
SMILESCCNc1ccc(C)cc1C(=O)Nc1ccc(F)c(C)c1
InChIInChI=1S/C17H19FN2O/c1-4-19-16-8-5-11(2)9-14(16)17(21)20-13-6-7-15(18)12(3)10-13/h5-10,19H,4H2,1-3H3,(H,20,21)
InChIKeyZKJZUYHVWODBPE-UHFFFAOYSA-N
XLogP4.13
TPSA41.13 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500286.35
LogP ≤ 54.13
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Related Compounds

5-chloro-2-(ethylamino)-N-(4-methylphenyl)benzamide
CID 62165915
2-(ethylamino)-5-methyl-N-phenylbenzamide
CID 62509479
2-(ethylamino)-N-(2-fluorophenyl)-5-methylbenzamide
CID 62511053
5-chloro-2-(ethylamino)-N-(2-fluoro-5-methylphenyl)benzamide
CID 62166155
N-(4-chlorophenyl)-5-methyl-2-(propylamino)benzamide
CID 63501109
N-(4-fluorophenyl)-5-methyl-2-(propylamino)benzamide
CID 62510349
5-chloro-N-(4-chlorophenyl)-2-(ethylamino)benzamide
CID 63501473
N-(2-chloro-5-fluorophenyl)-2-(ethylamino)-5-methylbenzamide
CID 107531156
N-(5-chloro-2-pyridinyl)-2-(ethylamino)-5-methylbenzamide
CID 62508806
N-(4-iodophenyl)-5-methyl-2-(propylamino)benzamide
CID 63499323
N-(3-bromo-4-fluorophenyl)-2-(ethylamino)benzamide
CID 104779865
2-(ethylamino)-N-(2-iodophenyl)-5-methylbenzamide
CID 62508809

Frequently Asked Questions

What is the IUPAC name of 2-(ethylamino)-N-(4-fluoro-3-methylphenyl)-5-methylbenzamide?
The IUPAC name of 2-(ethylamino)-N-(4-fluoro-3-methylphenyl)-5-methylbenzamide (CID 62813653) is 2-(ethylamino)-N-(4-fluoro-3-methylphenyl)-5-methylbenzamide.
What is the SMILES notation for 2-(ethylamino)-N-(4-fluoro-3-methylphenyl)-5-methylbenzamide?
The canonical SMILES for 2-(ethylamino)-N-(4-fluoro-3-methylphenyl)-5-methylbenzamide is CCNc1ccc(C)cc1C(=O)Nc1ccc(F)c(C)c1.
What is the InChIKey of 2-(ethylamino)-N-(4-fluoro-3-methylphenyl)-5-methylbenzamide?
The InChIKey is ZKJZUYHVWODBPE-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H19FN2O/c1-4-19-16-8-5-11(2)9-14(16)17(21)20-13-6-7-15(18)12(3)10-13/h5-10,19H,4H2,1-3H3,(H,20,21).
What are the key properties of 2-(ethylamino)-N-(4-fluoro-3-methylphenyl)-5-methylbenzamide?
2-(ethylamino)-N-(4-fluoro-3-methylphenyl)-5-methylbenzamide has a molecular weight of 286.35 g/mol, XLogP of 4.13, 4 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(ethylamino)-N-(4-fluoro-3-methylphenyl)-5-methylbenzamide is sourced from PubChem (CID 62813653), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).