4-(aminomethyl)-N-ethyl-N-(5-hydroxy-2-methylphenyl)benzamide

C17H20N2O2 — CID 107733330

IUPAC4-(aminomethyl)-N-ethyl-N-(5-hydroxy-2-methylphenyl)benzamide
SMILESCCN(C(=O)c1ccc(CN)cc1)c1cc(O)ccc1C
InChIInChI=1S/C17H20N2O2/c1-3-19(16-10-15(20)9-4-12(16)2)17(21)14-7-5-13(11-18)6-8-14/h4-10,20H,3,11,18H2,1-2H3
InChIKeyCMTGJFZOKNQKRE-UHFFFAOYSA-N
MW284.36 g/mol
LogP2.83
Rot. Bonds4

About 4-(aminomethyl)-N-ethyl-N-(5-hydroxy-2-methylphenyl)benzamide

4-(aminomethyl)-N-ethyl-N-(5-hydroxy-2-methylphenyl)benzamide (PubChem CID 107733330) has the molecular formula C17H20N2O2 and a molecular weight of 284.36 g/mol. Its IUPAC name is 4-(aminomethyl)-N-ethyl-N-(5-hydroxy-2-methylphenyl)benzamide.

Molecular Properties

Compound Name4-(aminomethyl)-N-ethyl-N-(5-hydroxy-2-methylphenyl)benzamide
PubChem CID107733330
Molecular FormulaC17H20N2O2
Molecular Weight284.36 g/mol
Exact Mass284.15
IUPAC Name4-(aminomethyl)-N-ethyl-N-(5-hydroxy-2-methylphenyl)benzamide
SMILESCCN(C(=O)c1ccc(CN)cc1)c1cc(O)ccc1C
InChIInChI=1S/C17H20N2O2/c1-3-19(16-10-15(20)9-4-12(16)2)17(21)14-7-5-13(11-18)6-8-14/h4-10,20H,3,11,18H2,1-2H3
InChIKeyCMTGJFZOKNQKRE-UHFFFAOYSA-N
XLogP2.83
TPSA66.56 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500284.36
LogP ≤ 52.83
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

Analyze 4-(aminomethyl)-N-ethyl-N-(5-hydroxy-2-methylphenyl)benzamide with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

N-ethyl-N-(5-hydroxy-2-methylphenyl)-4-iodobenzamide
CID 28978793
3-chloro-N-ethyl-4-hydroxy-N-(5-hydroxy-2-methylphenyl)benzamide
CID 29273643
N-ethyl-N-(5-hydroxy-2-methylphenyl)pyrimidine-5-carboxamide
CID 102922038
6-chloro-N-ethyl-N-(5-hydroxy-2-methylphenyl)pyridine-3-carboxamide
CID 107856541
4-(aminomethyl)-N-(2,5-dimethylphenyl)-N-methylbenzamide
CID 115161228
2-amino-N-ethyl-N-(5-hydroxy-2-methylphenyl)-5-methylbenzamide
CID 107733112
2-amino-5-bromo-N-ethyl-N-(5-hydroxy-2-methylphenyl)benzamide
CID 107736855
N-[4-(aminomethyl)phenyl]-4-hydroxy-N-propylbenzamide
CID 43275719
2-bromo-N-ethyl-N-(5-hydroxy-2-methylphenyl)benzamide
CID 28739954
N-ethyl-N-(5-hydroxy-2-methylphenyl)-5-methyl-1,2-oxazole-3-carboxamide
CID 28780674
N-ethyl-N-(5-hydroxy-2-methylphenyl)-2-methylfuran-3-carboxamide
CID 28740049
4-amino-N-ethyl-N-(5-hydroxy-2-methylphenyl)-2-methylbutanamide
CID 107734511

Frequently Asked Questions

What is the IUPAC name of 4-(aminomethyl)-N-ethyl-N-(5-hydroxy-2-methylphenyl)benzamide?
The IUPAC name of 4-(aminomethyl)-N-ethyl-N-(5-hydroxy-2-methylphenyl)benzamide (CID 107733330) is 4-(aminomethyl)-N-ethyl-N-(5-hydroxy-2-methylphenyl)benzamide.
What is the SMILES notation for 4-(aminomethyl)-N-ethyl-N-(5-hydroxy-2-methylphenyl)benzamide?
The canonical SMILES for 4-(aminomethyl)-N-ethyl-N-(5-hydroxy-2-methylphenyl)benzamide is CCN(C(=O)c1ccc(CN)cc1)c1cc(O)ccc1C.
What is the InChIKey of 4-(aminomethyl)-N-ethyl-N-(5-hydroxy-2-methylphenyl)benzamide?
The InChIKey is CMTGJFZOKNQKRE-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H20N2O2/c1-3-19(16-10-15(20)9-4-12(16)2)17(21)14-7-5-13(11-18)6-8-14/h4-10,20H,3,11,18H2,1-2H3.
What are the key properties of 4-(aminomethyl)-N-ethyl-N-(5-hydroxy-2-methylphenyl)benzamide?
4-(aminomethyl)-N-ethyl-N-(5-hydroxy-2-methylphenyl)benzamide has a molecular weight of 284.36 g/mol, XLogP of 2.83, 4 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 4-(aminomethyl)-N-ethyl-N-(5-hydroxy-2-methylphenyl)benzamide is sourced from PubChem (CID 107733330), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).