N-(3,5-dichlorophenyl)-4-(ethylamino)-3-methylbenzamide

C16H16Cl2N2O — CID 63501283

IUPACN-(3,5-dichlorophenyl)-4-(ethylamino)-3-methylbenzamide
SMILESCCNc1ccc(C(=O)Nc2cc(Cl)cc(Cl)c2)cc1C
InChIInChI=1S/C16H16Cl2N2O/c1-3-19-15-5-4-11(6-10(15)2)16(21)20-14-8-12(17)7-13(18)9-14/h4-9,19H,3H2,1-2H3,(H,20,21)
InChIKeyNHQUTQKGZXUZGF-UHFFFAOYSA-N
MW323.22 g/mol
LogP4.99
Rot. Bonds4

About N-(3,5-dichlorophenyl)-4-(ethylamino)-3-methylbenzamide

N-(3,5-dichlorophenyl)-4-(ethylamino)-3-methylbenzamide (PubChem CID 63501283) has the molecular formula C16H16Cl2N2O and a molecular weight of 323.22 g/mol. Its IUPAC name is N-(3,5-dichlorophenyl)-4-(ethylamino)-3-methylbenzamide.

Molecular Properties

Compound NameN-(3,5-dichlorophenyl)-4-(ethylamino)-3-methylbenzamide
PubChem CID63501283
Molecular FormulaC16H16Cl2N2O
Molecular Weight323.22 g/mol
Exact Mass322.06
IUPAC NameN-(3,5-dichlorophenyl)-4-(ethylamino)-3-methylbenzamide
SMILESCCNc1ccc(C(=O)Nc2cc(Cl)cc(Cl)c2)cc1C
InChIInChI=1S/C16H16Cl2N2O/c1-3-19-15-5-4-11(6-10(15)2)16(21)20-14-8-12(17)7-13(18)9-14/h4-9,19H,3H2,1-2H3,(H,20,21)
InChIKeyNHQUTQKGZXUZGF-UHFFFAOYSA-N
XLogP4.99
TPSA41.13 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500323.22
LogP ≤ 54.99
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Related Compounds

N-(3,4-dimethylphenyl)-4-(ethylamino)-3-methylbenzamide
CID 63209750
4-(ethylamino)-N-(3-fluoro-5-methylphenyl)-3-methylbenzamide
CID 79046684
N-(2-chloro-5-methylphenyl)-4-(ethylamino)-3-methylbenzamide
CID 107631262
4-(ethylamino)-3-methyl-N-thiophen-3-ylbenzamide
CID 66354623
4-(ethylamino)-3-methyl-N-(4-methylsulfanylphenyl)benzamide
CID 63209394
N-(2,6-dimethylphenyl)-4-(ethylamino)-3-methylbenzamide
CID 63210459
4-(ethylamino)-N-(6-methoxy-3-pyridinyl)-3-methylbenzamide
CID 63210411
N-(4-chlorophenyl)-4-[2-(dimethylamino)ethylamino]-3-methylbenzamide
CID 175893681
4-(ethylamino)-3-methyl-N-(2-methyl-3-pyridinyl)benzamide
CID 79043080
N-(5,6-dimethyl-1,2,4-triazin-3-yl)-4-(ethylamino)-3-methylbenzamide
CID 114389344
4-(ethylamino)-3-methyl-N-(1-methylcyclopropyl)benzamide
CID 113485970
methyl 4-(ethylamino)-3-methylbenzoate
CID 43730612

Frequently Asked Questions

What is the IUPAC name of N-(3,5-dichlorophenyl)-4-(ethylamino)-3-methylbenzamide?
The IUPAC name of N-(3,5-dichlorophenyl)-4-(ethylamino)-3-methylbenzamide (CID 63501283) is N-(3,5-dichlorophenyl)-4-(ethylamino)-3-methylbenzamide.
What is the SMILES notation for N-(3,5-dichlorophenyl)-4-(ethylamino)-3-methylbenzamide?
The canonical SMILES for N-(3,5-dichlorophenyl)-4-(ethylamino)-3-methylbenzamide is CCNc1ccc(C(=O)Nc2cc(Cl)cc(Cl)c2)cc1C.
What is the InChIKey of N-(3,5-dichlorophenyl)-4-(ethylamino)-3-methylbenzamide?
The InChIKey is NHQUTQKGZXUZGF-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H16Cl2N2O/c1-3-19-15-5-4-11(6-10(15)2)16(21)20-14-8-12(17)7-13(18)9-14/h4-9,19H,3H2,1-2H3,(H,20,21).
What are the key properties of N-(3,5-dichlorophenyl)-4-(ethylamino)-3-methylbenzamide?
N-(3,5-dichlorophenyl)-4-(ethylamino)-3-methylbenzamide has a molecular weight of 323.22 g/mol, XLogP of 4.99, 4 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-(3,5-dichlorophenyl)-4-(ethylamino)-3-methylbenzamide is sourced from PubChem (CID 63501283), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).