N-(3-amino-2,6-dimethylphenyl)-2-methoxy-5-methylbenzamide

C17H20N2O2 — CID 62503695

IUPACN-(3-amino-2,6-dimethylphenyl)-2-methoxy-5-methylbenzamide
SMILESCOc1ccc(C)cc1C(=O)Nc1c(C)ccc(N)c1C
InChIInChI=1S/C17H20N2O2/c1-10-5-8-15(21-4)13(9-10)17(20)19-16-11(2)6-7-14(18)12(16)3/h5-9H,18H2,1-4H3,(H,19,20)
InChIKeyFJMGZUZXBPOJAR-UHFFFAOYSA-N
MW284.36 g/mol
LogP3.45
Rot. Bonds3

About N-(3-amino-2,6-dimethylphenyl)-2-methoxy-5-methylbenzamide

N-(3-amino-2,6-dimethylphenyl)-2-methoxy-5-methylbenzamide (PubChem CID 62503695) has the molecular formula C17H20N2O2 and a molecular weight of 284.36 g/mol. Its IUPAC name is N-(3-amino-2,6-dimethylphenyl)-2-methoxy-5-methylbenzamide.

Molecular Properties

Compound NameN-(3-amino-2,6-dimethylphenyl)-2-methoxy-5-methylbenzamide
PubChem CID62503695
Molecular FormulaC17H20N2O2
Molecular Weight284.36 g/mol
Exact Mass284.15
IUPAC NameN-(3-amino-2,6-dimethylphenyl)-2-methoxy-5-methylbenzamide
SMILESCOc1ccc(C)cc1C(=O)Nc1c(C)ccc(N)c1C
InChIInChI=1S/C17H20N2O2/c1-10-5-8-15(21-4)13(9-10)17(20)19-16-11(2)6-7-14(18)12(16)3/h5-9H,18H2,1-4H3,(H,19,20)
InChIKeyFJMGZUZXBPOJAR-UHFFFAOYSA-N
XLogP3.45
TPSA64.35 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500284.36
LogP ≤ 53.45
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

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

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Related Compounds

N-(3-amino-2,6-dimethylphenyl)-2-hydroxy-3-methoxybenzamide
CID 24709290
N-(3-amino-2,6-dimethylphenyl)-3-hydroxy-4-methoxybenzamide
CID 79737127
N-(2-amino-4-bromo-6-methylphenyl)-2-methoxy-5-methylbenzamide
CID 62504551
N-(2-amino-4,6-dibromophenyl)-2-methoxy-5-methylbenzamide
CID 62504201
2-amino-N-(4-methoxy-3-methylphenyl)-5-methylbenzamide
CID 62510394
N-(3-amino-2,6-dimethylphenyl)-2-bromo-5-methoxybenzamide
CID 24703033
2-amino-N-(2,6-dimethylphenyl)-5-methylbenzamide
CID 55083036
N-(3-amino-2,6-dimethylphenyl)-2,4,6-trimethylbenzamide
CID 24707284
methyl N-(3-amino-2,6-dimethylphenyl)carbamate
CID 19857501
N-(3-amino-2,6-dimethylphenyl)-2-hydroxybenzamide
CID 24708392
N-(2,5-dimethylphenyl)-2,4,5-trimethoxybenzamide
CID 2596685
N-[5-(aminomethyl)-2-methylphenyl]-2-methoxy-5-methylbenzamide
CID 62505777

Frequently Asked Questions

What is the IUPAC name of N-(3-amino-2,6-dimethylphenyl)-2-methoxy-5-methylbenzamide?
The IUPAC name of N-(3-amino-2,6-dimethylphenyl)-2-methoxy-5-methylbenzamide (CID 62503695) is N-(3-amino-2,6-dimethylphenyl)-2-methoxy-5-methylbenzamide.
What is the SMILES notation for N-(3-amino-2,6-dimethylphenyl)-2-methoxy-5-methylbenzamide?
The canonical SMILES for N-(3-amino-2,6-dimethylphenyl)-2-methoxy-5-methylbenzamide is COc1ccc(C)cc1C(=O)Nc1c(C)ccc(N)c1C.
What is the InChIKey of N-(3-amino-2,6-dimethylphenyl)-2-methoxy-5-methylbenzamide?
The InChIKey is FJMGZUZXBPOJAR-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H20N2O2/c1-10-5-8-15(21-4)13(9-10)17(20)19-16-11(2)6-7-14(18)12(16)3/h5-9H,18H2,1-4H3,(H,19,20).
What are the key properties of N-(3-amino-2,6-dimethylphenyl)-2-methoxy-5-methylbenzamide?
N-(3-amino-2,6-dimethylphenyl)-2-methoxy-5-methylbenzamide has a molecular weight of 284.36 g/mol, XLogP of 3.45, 3 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-(3-amino-2,6-dimethylphenyl)-2-methoxy-5-methylbenzamide is sourced from PubChem (CID 62503695), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).