3-amino-N-(4-ethylphenyl)-4-methoxy-N-methylbenzamide

C17H20N2O2 — CID 62004047

IUPAC3-amino-N-(4-ethylphenyl)-4-methoxy-N-methylbenzamide
SMILESCCc1ccc(N(C)C(=O)c2ccc(OC)c(N)c2)cc1
InChIInChI=1S/C17H20N2O2/c1-4-12-5-8-14(9-6-12)19(2)17(20)13-7-10-16(21-3)15(18)11-13/h5-11H,4,18H2,1-3H3
InChIKeyZHTCQMRUJBEAHE-UHFFFAOYSA-N
MW284.36 g/mol
LogP3.12
Rot. Bonds4

About 3-amino-N-(4-ethylphenyl)-4-methoxy-N-methylbenzamide

3-amino-N-(4-ethylphenyl)-4-methoxy-N-methylbenzamide (PubChem CID 62004047) has the molecular formula C17H20N2O2 and a molecular weight of 284.36 g/mol. Its IUPAC name is 3-amino-N-(4-ethylphenyl)-4-methoxy-N-methylbenzamide.

Molecular Properties

Compound Name3-amino-N-(4-ethylphenyl)-4-methoxy-N-methylbenzamide
PubChem CID62004047
Molecular FormulaC17H20N2O2
Molecular Weight284.36 g/mol
Exact Mass284.15
IUPAC Name3-amino-N-(4-ethylphenyl)-4-methoxy-N-methylbenzamide
SMILESCCc1ccc(N(C)C(=O)c2ccc(OC)c(N)c2)cc1
InChIInChI=1S/C17H20N2O2/c1-4-12-5-8-14(9-6-12)19(2)17(20)13-7-10-16(21-3)15(18)11-13/h5-11H,4,18H2,1-3H3
InChIKeyZHTCQMRUJBEAHE-UHFFFAOYSA-N
XLogP3.12
TPSA55.56 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500284.36
LogP ≤ 53.12
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'aniline', 'substructure': 'N/A'}

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Related Compounds

3-amino-4-bromo-N-(4-ethylphenyl)-N-methylbenzamide
CID 62003107
N-(4-aminophenyl)-4-ethyl-N-methylbenzamide
CID 28894052
3-amino-N-(4-ethylphenyl)-5-methoxy-N-methylbenzamide
CID 81093516
3-amino-N,N-diethyl-4-methoxybenzamide
CID 16770695
N-(3-amino-4-methoxyphenyl)-4-ethylbenzamide
CID 43599944
3-amino-4-methoxy-N-(1-methoxypropan-2-yl)-N-methylbenzamide
CID 61109312
N-(4-ethylphenyl)-3,4-dihydroxy-N-methylbenzamide
CID 107728488
4-[(4-ethylphenyl)-methylcarbamoyl]benzoic acid
CID 62004416
3-amino-4-methoxy-N-methyl-N-(1-methylsulfanylpropan-2-yl)benzamide
CID 112656487
N-(3-amino-4-methoxyphenyl)-4-(4-ethylphenyl)-4-oxobutanamide
CID 119419435
N-(4-ethylphenyl)-2-hydroxy-4-methoxy-N-methylbenzamide
CID 62003405
N-(4-ethylphenyl)-5-iodo-N-methylthiophene-3-carboxamide
CID 79692778

Frequently Asked Questions

What is the IUPAC name of 3-amino-N-(4-ethylphenyl)-4-methoxy-N-methylbenzamide?
The IUPAC name of 3-amino-N-(4-ethylphenyl)-4-methoxy-N-methylbenzamide (CID 62004047) is 3-amino-N-(4-ethylphenyl)-4-methoxy-N-methylbenzamide.
What is the SMILES notation for 3-amino-N-(4-ethylphenyl)-4-methoxy-N-methylbenzamide?
The canonical SMILES for 3-amino-N-(4-ethylphenyl)-4-methoxy-N-methylbenzamide is CCc1ccc(N(C)C(=O)c2ccc(OC)c(N)c2)cc1.
What is the InChIKey of 3-amino-N-(4-ethylphenyl)-4-methoxy-N-methylbenzamide?
The InChIKey is ZHTCQMRUJBEAHE-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H20N2O2/c1-4-12-5-8-14(9-6-12)19(2)17(20)13-7-10-16(21-3)15(18)11-13/h5-11H,4,18H2,1-3H3.
What are the key properties of 3-amino-N-(4-ethylphenyl)-4-methoxy-N-methylbenzamide?
3-amino-N-(4-ethylphenyl)-4-methoxy-N-methylbenzamide has a molecular weight of 284.36 g/mol, XLogP of 3.12, 4 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 3-amino-N-(4-ethylphenyl)-4-methoxy-N-methylbenzamide is sourced from PubChem (CID 62004047), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).