5-chloro-N-(2,6-difluorophenyl)-2-(ethylamino)benzamide

C15H13ClF2N2O — CID 62165442

IUPAC5-chloro-N-(2,6-difluorophenyl)-2-(ethylamino)benzamide
SMILESCCNc1ccc(Cl)cc1C(=O)Nc1c(F)cccc1F
InChIInChI=1S/C15H13ClF2N2O/c1-2-19-13-7-6-9(16)8-10(13)15(21)20-14-11(17)4-3-5-12(14)18/h3-8,19H,2H2,1H3,(H,20,21)
InChIKeyHPAJHRVAEWMMSB-UHFFFAOYSA-N
MW310.73 g/mol
LogP4.30
Rot. Bonds4

About 5-chloro-N-(2,6-difluorophenyl)-2-(ethylamino)benzamide

5-chloro-N-(2,6-difluorophenyl)-2-(ethylamino)benzamide (PubChem CID 62165442) has the molecular formula C15H13ClF2N2O and a molecular weight of 310.73 g/mol. Its IUPAC name is 5-chloro-N-(2,6-difluorophenyl)-2-(ethylamino)benzamide.

Molecular Properties

Compound Name5-chloro-N-(2,6-difluorophenyl)-2-(ethylamino)benzamide
PubChem CID62165442
Molecular FormulaC15H13ClF2N2O
Molecular Weight310.73 g/mol
Exact Mass310.07
IUPAC Name5-chloro-N-(2,6-difluorophenyl)-2-(ethylamino)benzamide
SMILESCCNc1ccc(Cl)cc1C(=O)Nc1c(F)cccc1F
InChIInChI=1S/C15H13ClF2N2O/c1-2-19-13-7-6-9(16)8-10(13)15(21)20-14-11(17)4-3-5-12(14)18/h3-8,19H,2H2,1H3,(H,20,21)
InChIKeyHPAJHRVAEWMMSB-UHFFFAOYSA-N
XLogP4.30
TPSA41.13 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500310.73
LogP ≤ 54.30
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Related Compounds

N-(2-bromo-6-fluorophenyl)-5-chloro-2-(ethylamino)benzamide
CID 107603353
5-chloro-N-(2,4-difluorophenyl)-2-(ethylamino)benzamide
CID 62166930
5-chloro-N-(4-chlorophenyl)-2-(ethylamino)benzamide
CID 63501473
5-chloro-2-(ethylamino)-N-(2-fluoro-5-methylphenyl)benzamide
CID 62166155
5-chloro-N-(2-chloro-4-fluorophenyl)-2-(ethylamino)benzamide
CID 62166687
5-chloro-2-(ethylamino)-N-(4-methylphenyl)benzamide
CID 62165915
5-chloro-N-(4,6-dimethylpyrimidin-2-yl)-2-(ethylamino)benzamide
CID 62185060
5-chloro-2-(ethylamino)-N-(4-methoxyphenyl)benzamide
CID 62171434
5-chloro-N-(cyclopropylmethyl)-2-(ethylamino)benzamide
CID 62173260
2-(ethylamino)-N-(2-fluorophenyl)-5-methylbenzamide
CID 62511053
N-(3-bromo-5-methylphenyl)-5-chloro-2-(ethylamino)benzamide
CID 107578576
5-chloro-N-(4-cyanophenyl)-2-(ethylamino)benzamide
CID 62166224

Frequently Asked Questions

What is the IUPAC name of 5-chloro-N-(2,6-difluorophenyl)-2-(ethylamino)benzamide?
The IUPAC name of 5-chloro-N-(2,6-difluorophenyl)-2-(ethylamino)benzamide (CID 62165442) is 5-chloro-N-(2,6-difluorophenyl)-2-(ethylamino)benzamide.
What is the SMILES notation for 5-chloro-N-(2,6-difluorophenyl)-2-(ethylamino)benzamide?
The canonical SMILES for 5-chloro-N-(2,6-difluorophenyl)-2-(ethylamino)benzamide is CCNc1ccc(Cl)cc1C(=O)Nc1c(F)cccc1F.
What is the InChIKey of 5-chloro-N-(2,6-difluorophenyl)-2-(ethylamino)benzamide?
The InChIKey is HPAJHRVAEWMMSB-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H13ClF2N2O/c1-2-19-13-7-6-9(16)8-10(13)15(21)20-14-11(17)4-3-5-12(14)18/h3-8,19H,2H2,1H3,(H,20,21).
What are the key properties of 5-chloro-N-(2,6-difluorophenyl)-2-(ethylamino)benzamide?
5-chloro-N-(2,6-difluorophenyl)-2-(ethylamino)benzamide has a molecular weight of 310.73 g/mol, XLogP of 4.30, 4 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 5-chloro-N-(2,6-difluorophenyl)-2-(ethylamino)benzamide is sourced from PubChem (CID 62165442), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).