2-amino-5-hydroxy-N-[(2-methoxyphenyl)methyl]-N-methylbenzamide

C16H18N2O3 — CID 107074383

IUPAC2-amino-5-hydroxy-N-[(2-methoxyphenyl)methyl]-N-methylbenzamide
SMILESCOc1ccccc1CN(C)C(=O)c1cc(O)ccc1N
InChIInChI=1S/C16H18N2O3/c1-18(10-11-5-3-4-6-15(11)21-2)16(20)13-9-12(19)7-8-14(13)17/h3-9,19H,10,17H2,1-2H3
InChIKeyJEWZZODXJFJAAC-UHFFFAOYSA-N
MW286.33 g/mol
LogP2.26
Rot. Bonds4

About 2-amino-5-hydroxy-N-[(2-methoxyphenyl)methyl]-N-methylbenzamide

2-amino-5-hydroxy-N-[(2-methoxyphenyl)methyl]-N-methylbenzamide (PubChem CID 107074383) has the molecular formula C16H18N2O3 and a molecular weight of 286.33 g/mol. Its IUPAC name is 2-amino-5-hydroxy-N-[(2-methoxyphenyl)methyl]-N-methylbenzamide.

Molecular Properties

Compound Name2-amino-5-hydroxy-N-[(2-methoxyphenyl)methyl]-N-methylbenzamide
PubChem CID107074383
Molecular FormulaC16H18N2O3
Molecular Weight286.33 g/mol
Exact Mass286.13
IUPAC Name2-amino-5-hydroxy-N-[(2-methoxyphenyl)methyl]-N-methylbenzamide
SMILESCOc1ccccc1CN(C)C(=O)c1cc(O)ccc1N
InChIInChI=1S/C16H18N2O3/c1-18(10-11-5-3-4-6-15(11)21-2)16(20)13-9-12(19)7-8-14(13)17/h3-9,19H,10,17H2,1-2H3
InChIKeyJEWZZODXJFJAAC-UHFFFAOYSA-N
XLogP2.26
TPSA75.79 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500286.33
LogP ≤ 52.26
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

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

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Related Compounds

3-amino-N-[(2-methoxyphenyl)methyl]-N,2-dimethylbenzamide
CID 61112078
5-amino-2-chloro-N-[(2-methoxyphenyl)methyl]-N-methylbenzamide
CID 61111701
2-amino-5-bromo-N-[(2-methoxyphenyl)methyl]-N-methylpyridine-3-carboxamide
CID 62160081
N-[(2-aminophenyl)methyl]-2-hydroxy-3-methoxy-N-methylbenzamide
CID 43458368
5-fluoro-2-hydroxy-N-[(2-methoxyphenyl)methyl]-N-methylbenzamide
CID 79882419
3-amino-N-[(2-methoxyphenyl)methyl]-N,4-dimethylbenzamide
CID 61027377
5-amino-N-[(2-methoxyphenyl)methyl]-N,2-dimethylpyridine-3-carboxamide
CID 61112841
2-amino-N-[(2,4-difluorophenyl)methyl]-5-hydroxy-N-methylbenzamide
CID 107074426
2,6-dihydroxy-N-[(2-methoxyphenyl)methyl]-N-methylbenzamide
CID 103748911
5-bromo-2-iodo-N-[(2-methoxyphenyl)methyl]-N-methylbenzamide
CID 103600356
4-bromo-3,5-dimethoxy-N-[(2-methoxyphenyl)methyl]-N-methylbenzamide
CID 17412285
N-[(2-methoxyphenyl)methyl]-N-methyl-2-methylsulfanylbenzamide
CID 38005257

Frequently Asked Questions

What is the IUPAC name of 2-amino-5-hydroxy-N-[(2-methoxyphenyl)methyl]-N-methylbenzamide?
The IUPAC name of 2-amino-5-hydroxy-N-[(2-methoxyphenyl)methyl]-N-methylbenzamide (CID 107074383) is 2-amino-5-hydroxy-N-[(2-methoxyphenyl)methyl]-N-methylbenzamide.
What is the SMILES notation for 2-amino-5-hydroxy-N-[(2-methoxyphenyl)methyl]-N-methylbenzamide?
The canonical SMILES for 2-amino-5-hydroxy-N-[(2-methoxyphenyl)methyl]-N-methylbenzamide is COc1ccccc1CN(C)C(=O)c1cc(O)ccc1N.
What is the InChIKey of 2-amino-5-hydroxy-N-[(2-methoxyphenyl)methyl]-N-methylbenzamide?
The InChIKey is JEWZZODXJFJAAC-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H18N2O3/c1-18(10-11-5-3-4-6-15(11)21-2)16(20)13-9-12(19)7-8-14(13)17/h3-9,19H,10,17H2,1-2H3.
What are the key properties of 2-amino-5-hydroxy-N-[(2-methoxyphenyl)methyl]-N-methylbenzamide?
2-amino-5-hydroxy-N-[(2-methoxyphenyl)methyl]-N-methylbenzamide has a molecular weight of 286.33 g/mol, XLogP of 2.26, 4 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-amino-5-hydroxy-N-[(2-methoxyphenyl)methyl]-N-methylbenzamide is sourced from PubChem (CID 107074383), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).