N-(5-chloro-2-pyridinyl)-2,5-diethylbenzamide

C16H17ClN2O — CID 70908062

IUPACN-(5-chloro-2-pyridinyl)-2,5-diethylbenzamide
SMILESCCc1ccc(CC)c(C(=O)Nc2ccc(Cl)cn2)c1
InChIInChI=1S/C16H17ClN2O/c1-3-11-5-6-12(4-2)14(9-11)16(20)19-15-8-7-13(17)10-18-15/h5-10H,3-4H2,1-2H3,(H,18,19,20)
InChIKeyCYARRVYHVIUJBO-UHFFFAOYSA-N
MW288.78 g/mol
LogP4.11
Rot. Bonds4

About N-(5-chloro-2-pyridinyl)-2,5-diethylbenzamide

N-(5-chloro-2-pyridinyl)-2,5-diethylbenzamide (PubChem CID 70908062) has the molecular formula C16H17ClN2O and a molecular weight of 288.78 g/mol. Its IUPAC name is N-(5-chloro-2-pyridinyl)-2,5-diethylbenzamide.

Molecular Properties

Compound NameN-(5-chloro-2-pyridinyl)-2,5-diethylbenzamide
PubChem CID70908062
Molecular FormulaC16H17ClN2O
Molecular Weight288.78 g/mol
Exact Mass288.10
IUPAC NameN-(5-chloro-2-pyridinyl)-2,5-diethylbenzamide
SMILESCCc1ccc(CC)c(C(=O)Nc2ccc(Cl)cn2)c1
InChIInChI=1S/C16H17ClN2O/c1-3-11-5-6-12(4-2)14(9-11)16(20)19-15-8-7-13(17)10-18-15/h5-10H,3-4H2,1-2H3,(H,18,19,20)
InChIKeyCYARRVYHVIUJBO-UHFFFAOYSA-N
XLogP4.11
TPSA41.99 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500288.78
LogP ≤ 54.11
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

4,5-dichloro-1-N,2-N-bis(5-chloro-2-pyridinyl)benzene-1,2-dicarboxamide
CID 3421055
4-chloro-N-(5-chloro-2-pyridinyl)-6-methylpyridine-3-carboxamide
CID 81225634
N-[2-[(5-chloro-2-pyridinyl)carbamoyl]phenyl]-5-ethylfuran-2-carboxamide
CID 52867425
N-(5-chloro-2-pyridinyl)-2-(ethylamino)-5-methylbenzamide
CID 62508806
N-(5-chloro-2-pyridinyl)-2-methylbenzamide
CID 758009
2-bromo-5-chloro-N-(5-chloro-2-pyridinyl)benzamide
CID 103611566
N-(5-chloro-2-pyridinyl)-2-(4-methoxyphenyl)acetamide
CID 949027
N-(5-chloro-2-pyridinyl)-2-fluoro-4-methylbenzamide
CID 79770805
N-(5-chloro-2-pyridinyl)-2-hydroxy-5-methylbenzamide
CID 28831587
N-(5-chloro-2-pyridinyl)-5-(ethylamino)pyridine-2-carboxamide
CID 104640067
2-amino-N-(5-chloro-2-pyridinyl)-3-hydroxy-5-methylbenzamide
CID 153409482
N-(5-chloro-2-pyridinyl)-2-[2-(4-ethanimidoylphenyl)ethyl]-5-fluorobenzamide;methane
CID 161034320

Frequently Asked Questions

What is the IUPAC name of N-(5-chloro-2-pyridinyl)-2,5-diethylbenzamide?
The IUPAC name of N-(5-chloro-2-pyridinyl)-2,5-diethylbenzamide (CID 70908062) is N-(5-chloro-2-pyridinyl)-2,5-diethylbenzamide.
What is the SMILES notation for N-(5-chloro-2-pyridinyl)-2,5-diethylbenzamide?
The canonical SMILES for N-(5-chloro-2-pyridinyl)-2,5-diethylbenzamide is CCc1ccc(CC)c(C(=O)Nc2ccc(Cl)cn2)c1.
What is the InChIKey of N-(5-chloro-2-pyridinyl)-2,5-diethylbenzamide?
The InChIKey is CYARRVYHVIUJBO-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H17ClN2O/c1-3-11-5-6-12(4-2)14(9-11)16(20)19-15-8-7-13(17)10-18-15/h5-10H,3-4H2,1-2H3,(H,18,19,20).
What are the key properties of N-(5-chloro-2-pyridinyl)-2,5-diethylbenzamide?
N-(5-chloro-2-pyridinyl)-2,5-diethylbenzamide has a molecular weight of 288.78 g/mol, XLogP of 4.11, 4 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-(5-chloro-2-pyridinyl)-2,5-diethylbenzamide is sourced from PubChem (CID 70908062), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).