2-amino-N-[2-(2-methoxyethyl)phenyl]-4-methylbenzamide

C17H20N2O2 — CID 102907951

IUPAC2-amino-N-[2-(2-methoxyethyl)phenyl]-4-methylbenzamide
SMILESCOCCc1ccccc1NC(=O)c1ccc(C)cc1N
InChIInChI=1S/C17H20N2O2/c1-12-7-8-14(15(18)11-12)17(20)19-16-6-4-3-5-13(16)9-10-21-2/h3-8,11H,9-10,18H2,1-2H3,(H,19,20)
InChIKeyJZEFYQBOQIBEOR-UHFFFAOYSA-N
MW284.36 g/mol
LogP3.02
Rot. Bonds5

About 2-amino-N-[2-(2-methoxyethyl)phenyl]-4-methylbenzamide

2-amino-N-[2-(2-methoxyethyl)phenyl]-4-methylbenzamide (PubChem CID 102907951) has the molecular formula C17H20N2O2 and a molecular weight of 284.36 g/mol. Its IUPAC name is 2-amino-N-[2-(2-methoxyethyl)phenyl]-4-methylbenzamide.

Molecular Properties

Compound Name2-amino-N-[2-(2-methoxyethyl)phenyl]-4-methylbenzamide
PubChem CID102907951
Molecular FormulaC17H20N2O2
Molecular Weight284.36 g/mol
Exact Mass284.15
IUPAC Name2-amino-N-[2-(2-methoxyethyl)phenyl]-4-methylbenzamide
SMILESCOCCc1ccccc1NC(=O)c1ccc(C)cc1N
InChIInChI=1S/C17H20N2O2/c1-12-7-8-14(15(18)11-12)17(20)19-16-6-4-3-5-13(16)9-10-21-2/h3-8,11H,9-10,18H2,1-2H3,(H,19,20)
InChIKeyJZEFYQBOQIBEOR-UHFFFAOYSA-N
XLogP3.02
TPSA64.35 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500284.36
LogP ≤ 53.02
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

2-amino-5-fluoro-N-[2-(2-methoxyethyl)phenyl]benzamide
CID 102903161
2-amino-N-[2-(2-methoxyethyl)phenyl]-3-methylbenzamide
CID 102903119
2,3-dihydroxy-N-[2-(2-methoxyethyl)phenyl]benzamide
CID 102906466
2-amino-4-methoxy-N-[2-(methoxymethyl)phenyl]benzamide
CID 115412626
2-fluoro-4-hydroxy-N-[2-(2-methoxyethyl)phenyl]benzamide
CID 102978268
2-amino-N-[2-(hydroxymethyl)phenyl]-4-methoxybenzamide
CID 115412681
2-amino-3-fluoro-N-[2-(2-methoxyethyl)phenyl]pyridine-4-carboxamide
CID 102907943
N-[2-(2-methoxyethyl)phenyl]-2-methylpropanamide
CID 18982774
N-[2-(aminomethyl)phenyl]-2,4-dimethylbenzamide
CID 16772806
2-fluoro-4-methyl-N-(2-propylphenyl)benzamide
CID 79778827
2-amino-N-(2-chloro-3-pyridinyl)-4-methylbenzamide
CID 14209972
N-(2-ethylphenyl)-2,4-dimethylbenzamide
CID 953221

Frequently Asked Questions

What is the IUPAC name of 2-amino-N-[2-(2-methoxyethyl)phenyl]-4-methylbenzamide?
The IUPAC name of 2-amino-N-[2-(2-methoxyethyl)phenyl]-4-methylbenzamide (CID 102907951) is 2-amino-N-[2-(2-methoxyethyl)phenyl]-4-methylbenzamide.
What is the SMILES notation for 2-amino-N-[2-(2-methoxyethyl)phenyl]-4-methylbenzamide?
The canonical SMILES for 2-amino-N-[2-(2-methoxyethyl)phenyl]-4-methylbenzamide is COCCc1ccccc1NC(=O)c1ccc(C)cc1N.
What is the InChIKey of 2-amino-N-[2-(2-methoxyethyl)phenyl]-4-methylbenzamide?
The InChIKey is JZEFYQBOQIBEOR-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H20N2O2/c1-12-7-8-14(15(18)11-12)17(20)19-16-6-4-3-5-13(16)9-10-21-2/h3-8,11H,9-10,18H2,1-2H3,(H,19,20).
What are the key properties of 2-amino-N-[2-(2-methoxyethyl)phenyl]-4-methylbenzamide?
2-amino-N-[2-(2-methoxyethyl)phenyl]-4-methylbenzamide has a molecular weight of 284.36 g/mol, XLogP of 3.02, 5 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-amino-N-[2-(2-methoxyethyl)phenyl]-4-methylbenzamide is sourced from PubChem (CID 102907951), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).