2-amino-N-(2,6-dimethylpiperidin-1-yl)-4-methylbenzamide

C15H23N3O — CID 83025059

IUPAC2-amino-N-(2,6-dimethylpiperidin-1-yl)-4-methylbenzamide
SMILESCc1ccc(C(=O)NN2C(C)CCCC2C)c(N)c1
InChIInChI=1S/C15H23N3O/c1-10-7-8-13(14(16)9-10)15(19)17-18-11(2)5-4-6-12(18)3/h7-9,11-12H,4-6,16H2,1-3H3,(H,17,19)
InChIKeyRWDBYPGEGBEZCF-UHFFFAOYSA-N
MW261.37 g/mol
LogP2.48
Rot. Bonds2

About 2-amino-N-(2,6-dimethylpiperidin-1-yl)-4-methylbenzamide

2-amino-N-(2,6-dimethylpiperidin-1-yl)-4-methylbenzamide (PubChem CID 83025059) has the molecular formula C15H23N3O and a molecular weight of 261.37 g/mol. Its IUPAC name is 2-amino-N-(2,6-dimethylpiperidin-1-yl)-4-methylbenzamide.

Molecular Properties

Compound Name2-amino-N-(2,6-dimethylpiperidin-1-yl)-4-methylbenzamide
PubChem CID83025059
Molecular FormulaC15H23N3O
Molecular Weight261.37 g/mol
Exact Mass261.18
IUPAC Name2-amino-N-(2,6-dimethylpiperidin-1-yl)-4-methylbenzamide
SMILESCc1ccc(C(=O)NN2C(C)CCCC2C)c(N)c1
InChIInChI=1S/C15H23N3O/c1-10-7-8-13(14(16)9-10)15(19)17-18-11(2)5-4-6-12(18)3/h7-9,11-12H,4-6,16H2,1-3H3,(H,17,19)
InChIKeyRWDBYPGEGBEZCF-UHFFFAOYSA-N
XLogP2.48
TPSA58.36 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500261.37
LogP ≤ 52.48
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

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

Analyze 2-amino-N-(2,6-dimethylpiperidin-1-yl)-4-methylbenzamide 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

2-amino-N-(2,6-dimethylpiperidin-1-yl)-4-methoxybenzamide
CID 83021113
2-amino-3-chloro-N-(2,6-dimethylpiperidin-1-yl)benzamide
CID 83013273
2-amino-N-cyclopropyl-4-methylbenzamide;hydrochloride
CID 141105148
5-chloro-N-(2,6-dimethylpiperidin-1-yl)-2-hydroxybenzamide
CID 115279907
5-amino-N-(2,6-dimethylpiperidin-1-yl)-1-methylpyrazole-4-carboxamide
CID 83022591
2-bromo-N-(2,6-dimethylpiperidin-1-yl)-5-fluorobenzamide
CID 78911860
2,5-dibromo-N-(2,6-dimethylpiperidin-1-yl)thiophene-3-carboxamide
CID 107962323
3-amino-N-(2,6-dimethylpiperidin-1-yl)-4-ethoxybenzamide
CID 83003513
N-(2,6-dimethylpiperidin-1-yl)-2-hydroxy-5-methoxybenzamide
CID 115279910
N-(2,6-dimethylpiperidin-1-yl)-4-hydroxybenzamide
CID 78909911
2-chloro-N-(2,6-dimethylpiperidin-1-yl)pyridine-3-carboxamide
CID 78907835
4-bromo-N-[(2S,6S)-2,6-dimethylpiperidin-1-yl]benzamide
CID 40642612

Frequently Asked Questions

What is the IUPAC name of 2-amino-N-(2,6-dimethylpiperidin-1-yl)-4-methylbenzamide?
The IUPAC name of 2-amino-N-(2,6-dimethylpiperidin-1-yl)-4-methylbenzamide (CID 83025059) is 2-amino-N-(2,6-dimethylpiperidin-1-yl)-4-methylbenzamide.
What is the SMILES notation for 2-amino-N-(2,6-dimethylpiperidin-1-yl)-4-methylbenzamide?
The canonical SMILES for 2-amino-N-(2,6-dimethylpiperidin-1-yl)-4-methylbenzamide is Cc1ccc(C(=O)NN2C(C)CCCC2C)c(N)c1.
What is the InChIKey of 2-amino-N-(2,6-dimethylpiperidin-1-yl)-4-methylbenzamide?
The InChIKey is RWDBYPGEGBEZCF-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H23N3O/c1-10-7-8-13(14(16)9-10)15(19)17-18-11(2)5-4-6-12(18)3/h7-9,11-12H,4-6,16H2,1-3H3,(H,17,19).
What are the key properties of 2-amino-N-(2,6-dimethylpiperidin-1-yl)-4-methylbenzamide?
2-amino-N-(2,6-dimethylpiperidin-1-yl)-4-methylbenzamide has a molecular weight of 261.37 g/mol, XLogP of 2.48, 2 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-amino-N-(2,6-dimethylpiperidin-1-yl)-4-methylbenzamide is sourced from PubChem (CID 83025059), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).