N-(5-bromo-3-methyl-2-pyridinyl)-5-chloro-2-(ethylamino)benzamide

C15H15BrClN3O — CID 83167924

IUPACN-(5-bromo-3-methyl-2-pyridinyl)-5-chloro-2-(ethylamino)benzamide
SMILESCCNc1ccc(Cl)cc1C(=O)Nc1ncc(Br)cc1C
InChIInChI=1S/C15H15BrClN3O/c1-3-18-13-5-4-11(17)7-12(13)15(21)20-14-9(2)6-10(16)8-19-14/h4-8,18H,3H2,1-2H3,(H,19,20,21)
InChIKeyDNFNTGYOGIADEI-UHFFFAOYSA-N
MW368.66 g/mol
LogP4.49
Rot. Bonds4

About N-(5-bromo-3-methyl-2-pyridinyl)-5-chloro-2-(ethylamino)benzamide

N-(5-bromo-3-methyl-2-pyridinyl)-5-chloro-2-(ethylamino)benzamide (PubChem CID 83167924) has the molecular formula C15H15BrClN3O and a molecular weight of 368.66 g/mol. Its IUPAC name is N-(5-bromo-3-methyl-2-pyridinyl)-5-chloro-2-(ethylamino)benzamide.

Molecular Properties

Compound NameN-(5-bromo-3-methyl-2-pyridinyl)-5-chloro-2-(ethylamino)benzamide
PubChem CID83167924
Molecular FormulaC15H15BrClN3O
Molecular Weight368.66 g/mol
Exact Mass367.01
IUPAC NameN-(5-bromo-3-methyl-2-pyridinyl)-5-chloro-2-(ethylamino)benzamide
SMILESCCNc1ccc(Cl)cc1C(=O)Nc1ncc(Br)cc1C
InChIInChI=1S/C15H15BrClN3O/c1-3-18-13-5-4-11(17)7-12(13)15(21)20-14-9(2)6-10(16)8-19-14/h4-8,18H,3H2,1-2H3,(H,19,20,21)
InChIKeyDNFNTGYOGIADEI-UHFFFAOYSA-N
XLogP4.49
TPSA54.02 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500368.66
LogP ≤ 54.49
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

5-bromo-N-(5-bromo-3-methyl-2-pyridinyl)-2-(ethylamino)pyridine-3-carboxamide
CID 83169522
N-(3-bromo-5-methylphenyl)-5-chloro-2-(ethylamino)benzamide
CID 107578576
N-(5-bromo-3-methyl-2-pyridinyl)-2-chloro-4-methylbenzamide
CID 106509648
5-chloro-N-(4-chlorophenyl)-2-(ethylamino)benzamide
CID 63501473
5-chloro-N-(4,6-dimethylpyrimidin-2-yl)-2-(ethylamino)benzamide
CID 62185060
N-(5-bromo-3-methyl-2-pyridinyl)-4-chloropyridine-3-carboxamide
CID 83166694
5-chloro-2-(ethylamino)-N-(4-methyl-2-pyridinyl)benzamide
CID 62165937
5-chloro-2-(ethylamino)-N-(4-methylphenyl)benzamide
CID 62165915
N-(5-chloro-2-pyridinyl)-2-(ethylamino)-5-methylbenzamide
CID 62508806
5-chloro-N-(2-chloro-4-fluorophenyl)-2-(ethylamino)benzamide
CID 62166687
5-chloro-2-(ethylamino)-N-(2-fluoro-5-methylphenyl)benzamide
CID 62166155
5-bromo-N-(5-bromo-3-methyl-2-pyridinyl)-2-hydroxybenzamide
CID 113266660

Frequently Asked Questions

What is the IUPAC name of N-(5-bromo-3-methyl-2-pyridinyl)-5-chloro-2-(ethylamino)benzamide?
The IUPAC name of N-(5-bromo-3-methyl-2-pyridinyl)-5-chloro-2-(ethylamino)benzamide (CID 83167924) is N-(5-bromo-3-methyl-2-pyridinyl)-5-chloro-2-(ethylamino)benzamide.
What is the SMILES notation for N-(5-bromo-3-methyl-2-pyridinyl)-5-chloro-2-(ethylamino)benzamide?
The canonical SMILES for N-(5-bromo-3-methyl-2-pyridinyl)-5-chloro-2-(ethylamino)benzamide is CCNc1ccc(Cl)cc1C(=O)Nc1ncc(Br)cc1C.
What is the InChIKey of N-(5-bromo-3-methyl-2-pyridinyl)-5-chloro-2-(ethylamino)benzamide?
The InChIKey is DNFNTGYOGIADEI-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H15BrClN3O/c1-3-18-13-5-4-11(17)7-12(13)15(21)20-14-9(2)6-10(16)8-19-14/h4-8,18H,3H2,1-2H3,(H,19,20,21).
What are the key properties of N-(5-bromo-3-methyl-2-pyridinyl)-5-chloro-2-(ethylamino)benzamide?
N-(5-bromo-3-methyl-2-pyridinyl)-5-chloro-2-(ethylamino)benzamide has a molecular weight of 368.66 g/mol, XLogP of 4.49, 4 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-(5-bromo-3-methyl-2-pyridinyl)-5-chloro-2-(ethylamino)benzamide is sourced from PubChem (CID 83167924), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).