N-(3,4-dimethylphenyl)-4-(ethylamino)-3-methylbenzamide

C18H22N2O — CID 63209750

IUPACN-(3,4-dimethylphenyl)-4-(ethylamino)-3-methylbenzamide
SMILESCCNc1ccc(C(=O)Nc2ccc(C)c(C)c2)cc1C
InChIInChI=1S/C18H22N2O/c1-5-19-17-9-7-15(10-14(17)4)18(21)20-16-8-6-12(2)13(3)11-16/h6-11,19H,5H2,1-4H3,(H,20,21)
InChIKeyLDGPFUXQNLFIDF-UHFFFAOYSA-N
MW282.39 g/mol
LogP4.30
Rot. Bonds4

About N-(3,4-dimethylphenyl)-4-(ethylamino)-3-methylbenzamide

N-(3,4-dimethylphenyl)-4-(ethylamino)-3-methylbenzamide (PubChem CID 63209750) has the molecular formula C18H22N2O and a molecular weight of 282.39 g/mol. Its IUPAC name is N-(3,4-dimethylphenyl)-4-(ethylamino)-3-methylbenzamide.

Molecular Properties

Compound NameN-(3,4-dimethylphenyl)-4-(ethylamino)-3-methylbenzamide
PubChem CID63209750
Molecular FormulaC18H22N2O
Molecular Weight282.39 g/mol
Exact Mass282.17
IUPAC NameN-(3,4-dimethylphenyl)-4-(ethylamino)-3-methylbenzamide
SMILESCCNc1ccc(C(=O)Nc2ccc(C)c(C)c2)cc1C
InChIInChI=1S/C18H22N2O/c1-5-19-17-9-7-15(10-14(17)4)18(21)20-16-8-6-12(2)13(3)11-16/h6-11,19H,5H2,1-4H3,(H,20,21)
InChIKeyLDGPFUXQNLFIDF-UHFFFAOYSA-N
XLogP4.30
TPSA41.13 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500282.39
LogP ≤ 54.30
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Related Compounds

4-(ethylamino)-3-methyl-N-(4-methylsulfanylphenyl)benzamide
CID 63209394
N-(3,5-dichlorophenyl)-4-(ethylamino)-3-methylbenzamide
CID 63501283
4-(ethylamino)-3-methyl-N-thiophen-3-ylbenzamide
CID 66354623
4-(ethylamino)-N-(3-fluoro-5-methylphenyl)-3-methylbenzamide
CID 79046684
N-(2,6-dimethylphenyl)-4-(ethylamino)-3-methylbenzamide
CID 63210459
N-[4-[(2-aminoacetyl)amino]-2-methylphenyl]-3,4-dimethylbenzamide
CID 39185496
4-(ethylamino)-N-(6-methoxy-3-pyridinyl)-3-methylbenzamide
CID 63210411
4-bromo-N-(3,4-dimethylphenyl)-3-methylbenzamide
CID 113396743
N-(3-amino-4-ethylphenyl)-3,4-dimethylbenzamide
CID 28866890
3,4-dimethyl-N-(4-methylphenyl)benzamide
CID 3950718
N-(2-chloro-5-methylphenyl)-4-(ethylamino)-3-methylbenzamide
CID 107631262
4-(ethylamino)-3-methyl-N-(2-methyl-3-pyridinyl)benzamide
CID 79043080

Frequently Asked Questions

What is the IUPAC name of N-(3,4-dimethylphenyl)-4-(ethylamino)-3-methylbenzamide?
The IUPAC name of N-(3,4-dimethylphenyl)-4-(ethylamino)-3-methylbenzamide (CID 63209750) is N-(3,4-dimethylphenyl)-4-(ethylamino)-3-methylbenzamide.
What is the SMILES notation for N-(3,4-dimethylphenyl)-4-(ethylamino)-3-methylbenzamide?
The canonical SMILES for N-(3,4-dimethylphenyl)-4-(ethylamino)-3-methylbenzamide is CCNc1ccc(C(=O)Nc2ccc(C)c(C)c2)cc1C.
What is the InChIKey of N-(3,4-dimethylphenyl)-4-(ethylamino)-3-methylbenzamide?
The InChIKey is LDGPFUXQNLFIDF-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H22N2O/c1-5-19-17-9-7-15(10-14(17)4)18(21)20-16-8-6-12(2)13(3)11-16/h6-11,19H,5H2,1-4H3,(H,20,21).
What are the key properties of N-(3,4-dimethylphenyl)-4-(ethylamino)-3-methylbenzamide?
N-(3,4-dimethylphenyl)-4-(ethylamino)-3-methylbenzamide has a molecular weight of 282.39 g/mol, XLogP of 4.30, 4 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-(3,4-dimethylphenyl)-4-(ethylamino)-3-methylbenzamide is sourced from PubChem (CID 63209750), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).