5-chloro-2-(ethylamino)-N-(2-fluoro-5-methylphenyl)benzamide

C16H16ClFN2O — CID 62166155

IUPAC5-chloro-2-(ethylamino)-N-(2-fluoro-5-methylphenyl)benzamide
SMILESCCNc1ccc(Cl)cc1C(=O)Nc1cc(C)ccc1F
InChIInChI=1S/C16H16ClFN2O/c1-3-19-14-7-5-11(17)9-12(14)16(21)20-15-8-10(2)4-6-13(15)18/h4-9,19H,3H2,1-2H3,(H,20,21)
InChIKeyKHRLGQLMEYSSRS-UHFFFAOYSA-N
MW306.77 g/mol
LogP4.47
Rot. Bonds4

About 5-chloro-2-(ethylamino)-N-(2-fluoro-5-methylphenyl)benzamide

5-chloro-2-(ethylamino)-N-(2-fluoro-5-methylphenyl)benzamide (PubChem CID 62166155) has the molecular formula C16H16ClFN2O and a molecular weight of 306.77 g/mol. Its IUPAC name is 5-chloro-2-(ethylamino)-N-(2-fluoro-5-methylphenyl)benzamide.

Molecular Properties

Compound Name5-chloro-2-(ethylamino)-N-(2-fluoro-5-methylphenyl)benzamide
PubChem CID62166155
Molecular FormulaC16H16ClFN2O
Molecular Weight306.77 g/mol
Exact Mass306.09
IUPAC Name5-chloro-2-(ethylamino)-N-(2-fluoro-5-methylphenyl)benzamide
SMILESCCNc1ccc(Cl)cc1C(=O)Nc1cc(C)ccc1F
InChIInChI=1S/C16H16ClFN2O/c1-3-19-14-7-5-11(17)9-12(14)16(21)20-15-8-10(2)4-6-13(15)18/h4-9,19H,3H2,1-2H3,(H,20,21)
InChIKeyKHRLGQLMEYSSRS-UHFFFAOYSA-N
XLogP4.47
TPSA41.13 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500306.77
LogP ≤ 54.47
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)-N-(2-fluorophenyl)-5-methylbenzamide
CID 62511053
5-chloro-N-(2,4-difluorophenyl)-2-(ethylamino)benzamide
CID 62166930
5-chloro-N-(2-chloro-4-fluorophenyl)-2-(ethylamino)benzamide
CID 62166687
5-chloro-N-(2,6-difluorophenyl)-2-(ethylamino)benzamide
CID 62165442
N-(2-chloro-5-fluorophenyl)-2-(ethylamino)-5-methylbenzamide
CID 107531156
5-chloro-N-(4-chlorophenyl)-2-(ethylamino)benzamide
CID 63501473
5-chloro-2-(ethylamino)-N-(4-methyl-2-pyridinyl)benzamide
CID 62165937
2-(ethylamino)-N-(4-fluoro-3-methylphenyl)-5-methylbenzamide
CID 62813653
N-(5-chloro-2-fluorophenyl)-2-fluoro-4-methylbenzamide
CID 79770803
N-(3-bromo-5-methylphenyl)-5-chloro-2-(ethylamino)benzamide
CID 107578576
N-(5-chloro-2-pyridinyl)-2-(ethylamino)-5-methylbenzamide
CID 62508806

Frequently Asked Questions

What is the IUPAC name of 5-chloro-2-(ethylamino)-N-(2-fluoro-5-methylphenyl)benzamide?
The IUPAC name of 5-chloro-2-(ethylamino)-N-(2-fluoro-5-methylphenyl)benzamide (CID 62166155) is 5-chloro-2-(ethylamino)-N-(2-fluoro-5-methylphenyl)benzamide.
What is the SMILES notation for 5-chloro-2-(ethylamino)-N-(2-fluoro-5-methylphenyl)benzamide?
The canonical SMILES for 5-chloro-2-(ethylamino)-N-(2-fluoro-5-methylphenyl)benzamide is CCNc1ccc(Cl)cc1C(=O)Nc1cc(C)ccc1F.
What is the InChIKey of 5-chloro-2-(ethylamino)-N-(2-fluoro-5-methylphenyl)benzamide?
The InChIKey is KHRLGQLMEYSSRS-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H16ClFN2O/c1-3-19-14-7-5-11(17)9-12(14)16(21)20-15-8-10(2)4-6-13(15)18/h4-9,19H,3H2,1-2H3,(H,20,21).
What are the key properties of 5-chloro-2-(ethylamino)-N-(2-fluoro-5-methylphenyl)benzamide?
5-chloro-2-(ethylamino)-N-(2-fluoro-5-methylphenyl)benzamide has a molecular weight of 306.77 g/mol, XLogP of 4.47, 4 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 5-chloro-2-(ethylamino)-N-(2-fluoro-5-methylphenyl)benzamide is sourced from PubChem (CID 62166155), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).