4-[2-[3-(methylamino)piperidin-1-yl]propanoylamino]benzamide

C16H24N4O2 — CID 119920088

IUPAC4-[2-[3-(methylamino)piperidin-1-yl]propanoylamino]benzamide
SMILESCNC1CCCN(C(C)C(=O)Nc2ccc(C(N)=O)cc2)C1
InChIInChI=1S/C16H24N4O2/c1-11(20-9-3-4-14(10-20)18-2)16(22)19-13-7-5-12(6-8-13)15(17)21/h5-8,11,14,18H,3-4,9-10H2,1-2H3,(H2,17,21)(H,19,22)
InChIKeyRAZTUIQKQNZQAI-UHFFFAOYSA-N
MW304.39 g/mol
LogP0.80
Rot. Bonds5

About 4-[2-[3-(methylamino)piperidin-1-yl]propanoylamino]benzamide

4-[2-[3-(methylamino)piperidin-1-yl]propanoylamino]benzamide (PubChem CID 119920088) has the molecular formula C16H24N4O2 and a molecular weight of 304.39 g/mol. Its IUPAC name is 4-[2-[3-(methylamino)piperidin-1-yl]propanoylamino]benzamide.

Molecular Properties

Compound Name4-[2-[3-(methylamino)piperidin-1-yl]propanoylamino]benzamide
PubChem CID119920088
Molecular FormulaC16H24N4O2
Molecular Weight304.39 g/mol
Exact Mass304.19
IUPAC Name4-[2-[3-(methylamino)piperidin-1-yl]propanoylamino]benzamide
SMILESCNC1CCCN(C(C)C(=O)Nc2ccc(C(N)=O)cc2)C1
InChIInChI=1S/C16H24N4O2/c1-11(20-9-3-4-14(10-20)18-2)16(22)19-13-7-5-12(6-8-13)15(17)21/h5-8,11,14,18H,3-4,9-10H2,1-2H3,(H2,17,21)(H,19,22)
InChIKeyRAZTUIQKQNZQAI-UHFFFAOYSA-N
XLogP0.80
TPSA87.46 Ų
H-Bond Donors3
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500304.39
LogP ≤ 50.80
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 104

Analyze 4-[2-[3-(methylamino)piperidin-1-yl]propanoylamino]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

2-[3-(methylamino)piperidin-1-yl]-N-(4-sulfamoylphenyl)propanamide;hydrochloride
CID 119918352
N-(3-chlorophenyl)-2-[3-(methylamino)piperidin-1-yl]propanamide;hydrochloride
CID 119918800
2-[3-(methylamino)piperidin-1-yl]-N-(3-sulfamoylphenyl)propanamide;hydrochloride
CID 119918280
2-[3-(methylamino)piperidin-1-yl]-N-(2-oxo-1,3-dihydrobenzimidazol-5-yl)propanamide
CID 119918874
N-(4-acetylphenyl)-2-(3-methylpiperidin-1-yl)propanamide
CID 4825469
N-(4-acetylphenyl)-2-[3-(trifluoromethyl)piperidin-1-yl]propanamide
CID 17411208
4-[[(2R)-2-[(3R)-3-(1,3-benzoxazol-2-yl)piperidin-1-yl]propanoyl]amino]benzamide
CID 31986928
N-(2,6-difluorophenyl)-2-[3-(methylamino)piperidin-1-yl]propanamide;hydrochloride
CID 119918498
4-[2-(4-ethyl-1,4-diazepan-1-yl)propanoylamino]benzamide
CID 71930636
2-[3-(methylamino)piperidin-1-yl]-N-[3-(2-oxopyrrolidin-1-yl)phenyl]propanamide;hydrochloride
CID 119919119
N-(4-chlorophenyl)-2-(3-methylpiperidin-1-yl)propanamide
CID 4824476
N-(4-aminophenyl)-2-(3-methoxypiperidin-1-yl)propanamide
CID 102956363

Frequently Asked Questions

What is the IUPAC name of 4-[2-[3-(methylamino)piperidin-1-yl]propanoylamino]benzamide?
The IUPAC name of 4-[2-[3-(methylamino)piperidin-1-yl]propanoylamino]benzamide (CID 119920088) is 4-[2-[3-(methylamino)piperidin-1-yl]propanoylamino]benzamide.
What is the SMILES notation for 4-[2-[3-(methylamino)piperidin-1-yl]propanoylamino]benzamide?
The canonical SMILES for 4-[2-[3-(methylamino)piperidin-1-yl]propanoylamino]benzamide is CNC1CCCN(C(C)C(=O)Nc2ccc(C(N)=O)cc2)C1.
What is the InChIKey of 4-[2-[3-(methylamino)piperidin-1-yl]propanoylamino]benzamide?
The InChIKey is RAZTUIQKQNZQAI-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H24N4O2/c1-11(20-9-3-4-14(10-20)18-2)16(22)19-13-7-5-12(6-8-13)15(17)21/h5-8,11,14,18H,3-4,9-10H2,1-2H3,(H2,17,21)(H,19,22).
What are the key properties of 4-[2-[3-(methylamino)piperidin-1-yl]propanoylamino]benzamide?
4-[2-[3-(methylamino)piperidin-1-yl]propanoylamino]benzamide has a molecular weight of 304.39 g/mol, XLogP of 0.80, 5 rotatable bonds, 3 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 4-[2-[3-(methylamino)piperidin-1-yl]propanoylamino]benzamide is sourced from PubChem (CID 119920088), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).