N-(5-chloro-2-methylphenyl)-4-(ethylamino)benzamide

C16H17ClN2O — CID 62185728

IUPACN-(5-chloro-2-methylphenyl)-4-(ethylamino)benzamide
SMILESCCNc1ccc(C(=O)Nc2cc(Cl)ccc2C)cc1
InChIInChI=1S/C16H17ClN2O/c1-3-18-14-8-5-12(6-9-14)16(20)19-15-10-13(17)7-4-11(15)2/h4-10,18H,3H2,1-2H3,(H,19,20)
InChIKeyZLYOZNDKAHCVAR-UHFFFAOYSA-N
MW288.78 g/mol
LogP4.33
Rot. Bonds4

About N-(5-chloro-2-methylphenyl)-4-(ethylamino)benzamide

N-(5-chloro-2-methylphenyl)-4-(ethylamino)benzamide (PubChem CID 62185728) has the molecular formula C16H17ClN2O and a molecular weight of 288.78 g/mol. Its IUPAC name is N-(5-chloro-2-methylphenyl)-4-(ethylamino)benzamide.

Molecular Properties

Compound NameN-(5-chloro-2-methylphenyl)-4-(ethylamino)benzamide
PubChem CID62185728
Molecular FormulaC16H17ClN2O
Molecular Weight288.78 g/mol
Exact Mass288.10
IUPAC NameN-(5-chloro-2-methylphenyl)-4-(ethylamino)benzamide
SMILESCCNc1ccc(C(=O)Nc2cc(Cl)ccc2C)cc1
InChIInChI=1S/C16H17ClN2O/c1-3-18-14-8-5-12(6-9-14)16(20)19-15-10-13(17)7-4-11(15)2/h4-10,18H,3H2,1-2H3,(H,19,20)
InChIKeyZLYOZNDKAHCVAR-UHFFFAOYSA-N
XLogP4.33
TPSA41.13 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500288.78
LogP ≤ 54.33
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Related Compounds

4-[(5-chloro-2-methylphenyl)carbamoyl]benzoic acid
CID 43386540
N-(5-chloro-2-methylphenyl)-6-(ethylamino)pyridine-3-carboxamide
CID 62184893
4-[[2-(5-chloro-2-methylanilino)-2-oxoethyl]amino]-N-propan-2-ylbenzamide
CID 54840290
N-(5-chloro-2-methylphenyl)-3,5-dimethylbenzamide
CID 918666
N-(2,5-difluorophenyl)-4-(ethylamino)benzamide
CID 62172591
N-(2-chlorophenyl)-4-(ethylamino)benzamide
CID 62167613
N-(5-chloro-2-methylphenyl)-4-[(Z)-N'-hydroxycarbamimidoyl]benzamide
CID 43333228
4-[[2-(5-chloro-2-methylanilino)-2-oxoethyl]amino]-N,N-diethylbenzamide
CID 54834006
N-(5-chloro-2-methylphenyl)-4-(2-ethoxyethoxy)benzamide
CID 17112665
4-(tert-butylsulfamoyl)-N-(5-chloro-2-methylphenyl)benzamide
CID 29411178
N-(5-chloro-2-methylphenyl)-3-(propanoylamino)benzamide
CID 17309672
4-(ethylamino)-N-(2,4,6-trimethylphenyl)benzamide
CID 62186255

Frequently Asked Questions

What is the IUPAC name of N-(5-chloro-2-methylphenyl)-4-(ethylamino)benzamide?
The IUPAC name of N-(5-chloro-2-methylphenyl)-4-(ethylamino)benzamide (CID 62185728) is N-(5-chloro-2-methylphenyl)-4-(ethylamino)benzamide.
What is the SMILES notation for N-(5-chloro-2-methylphenyl)-4-(ethylamino)benzamide?
The canonical SMILES for N-(5-chloro-2-methylphenyl)-4-(ethylamino)benzamide is CCNc1ccc(C(=O)Nc2cc(Cl)ccc2C)cc1.
What is the InChIKey of N-(5-chloro-2-methylphenyl)-4-(ethylamino)benzamide?
The InChIKey is ZLYOZNDKAHCVAR-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H17ClN2O/c1-3-18-14-8-5-12(6-9-14)16(20)19-15-10-13(17)7-4-11(15)2/h4-10,18H,3H2,1-2H3,(H,19,20).
What are the key properties of N-(5-chloro-2-methylphenyl)-4-(ethylamino)benzamide?
N-(5-chloro-2-methylphenyl)-4-(ethylamino)benzamide has a molecular weight of 288.78 g/mol, XLogP of 4.33, 4 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-(5-chloro-2-methylphenyl)-4-(ethylamino)benzamide is sourced from PubChem (CID 62185728), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).