N-(4-amino-2,5-dimethylphenyl)-2-methoxybenzamide

C16H18N2O2 — CID 103144625

IUPACN-(4-amino-2,5-dimethylphenyl)-2-methoxybenzamide
SMILESCOc1ccccc1C(=O)Nc1cc(C)c(N)cc1C
InChIInChI=1S/C16H18N2O2/c1-10-9-14(11(2)8-13(10)17)18-16(19)12-6-4-5-7-15(12)20-3/h4-9H,17H2,1-3H3,(H,18,19)
InChIKeyJOLQOYUCULWSFU-UHFFFAOYSA-N
MW270.33 g/mol
LogP3.15
Rot. Bonds3

About N-(4-amino-2,5-dimethylphenyl)-2-methoxybenzamide

N-(4-amino-2,5-dimethylphenyl)-2-methoxybenzamide (PubChem CID 103144625) has the molecular formula C16H18N2O2 and a molecular weight of 270.33 g/mol. Its IUPAC name is N-(4-amino-2,5-dimethylphenyl)-2-methoxybenzamide.

Molecular Properties

Compound NameN-(4-amino-2,5-dimethylphenyl)-2-methoxybenzamide
PubChem CID103144625
Molecular FormulaC16H18N2O2
Molecular Weight270.33 g/mol
Exact Mass270.14
IUPAC NameN-(4-amino-2,5-dimethylphenyl)-2-methoxybenzamide
SMILESCOc1ccccc1C(=O)Nc1cc(C)c(N)cc1C
InChIInChI=1S/C16H18N2O2/c1-10-9-14(11(2)8-13(10)17)18-16(19)12-6-4-5-7-15(12)20-3/h4-9H,17H2,1-3H3,(H,18,19)
InChIKeyJOLQOYUCULWSFU-UHFFFAOYSA-N
XLogP3.15
TPSA64.35 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms20
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500270.33
LogP ≤ 53.15
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

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

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Frequently Asked Questions

What is the IUPAC name of N-(4-amino-2,5-dimethylphenyl)-2-methoxybenzamide?
The IUPAC name of N-(4-amino-2,5-dimethylphenyl)-2-methoxybenzamide (CID 103144625) is N-(4-amino-2,5-dimethylphenyl)-2-methoxybenzamide.
What is the SMILES notation for N-(4-amino-2,5-dimethylphenyl)-2-methoxybenzamide?
The canonical SMILES for N-(4-amino-2,5-dimethylphenyl)-2-methoxybenzamide is COc1ccccc1C(=O)Nc1cc(C)c(N)cc1C.
What is the InChIKey of N-(4-amino-2,5-dimethylphenyl)-2-methoxybenzamide?
The InChIKey is JOLQOYUCULWSFU-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H18N2O2/c1-10-9-14(11(2)8-13(10)17)18-16(19)12-6-4-5-7-15(12)20-3/h4-9H,17H2,1-3H3,(H,18,19).
What are the key properties of N-(4-amino-2,5-dimethylphenyl)-2-methoxybenzamide?
N-(4-amino-2,5-dimethylphenyl)-2-methoxybenzamide has a molecular weight of 270.33 g/mol, XLogP of 3.15, 3 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-(4-amino-2,5-dimethylphenyl)-2-methoxybenzamide is sourced from PubChem (CID 103144625), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).