N-(4-acetylphenyl)-3-[3-(methylamino)piperidin-1-yl]propanamide

C17H25N3O2 — CID 119919130

IUPACN-(4-acetylphenyl)-3-[3-(methylamino)piperidin-1-yl]propanamide
SMILESCNC1CCCN(CCC(=O)Nc2ccc(C(C)=O)cc2)C1
InChIInChI=1S/C17H25N3O2/c1-13(21)14-5-7-15(8-6-14)19-17(22)9-11-20-10-3-4-16(12-20)18-2/h5-8,16,18H,3-4,9-12H2,1-2H3,(H,19,22)
InChIKeyYVZJCHBSGJXUGZ-UHFFFAOYSA-N
MW303.41 g/mol
LogP1.90
Rot. Bonds6

About N-(4-acetylphenyl)-3-[3-(methylamino)piperidin-1-yl]propanamide

N-(4-acetylphenyl)-3-[3-(methylamino)piperidin-1-yl]propanamide (PubChem CID 119919130) has the molecular formula C17H25N3O2 and a molecular weight of 303.41 g/mol. Its IUPAC name is N-(4-acetylphenyl)-3-[3-(methylamino)piperidin-1-yl]propanamide.

Molecular Properties

Compound NameN-(4-acetylphenyl)-3-[3-(methylamino)piperidin-1-yl]propanamide
PubChem CID119919130
Molecular FormulaC17H25N3O2
Molecular Weight303.41 g/mol
Exact Mass303.19
IUPAC NameN-(4-acetylphenyl)-3-[3-(methylamino)piperidin-1-yl]propanamide
SMILESCNC1CCCN(CCC(=O)Nc2ccc(C(C)=O)cc2)C1
InChIInChI=1S/C17H25N3O2/c1-13(21)14-5-7-15(8-6-14)19-17(22)9-11-20-10-3-4-16(12-20)18-2/h5-8,16,18H,3-4,9-12H2,1-2H3,(H,19,22)
InChIKeyYVZJCHBSGJXUGZ-UHFFFAOYSA-N
XLogP1.90
TPSA61.44 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds6
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500303.41
LogP ≤ 51.90
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

Analyze N-(4-acetylphenyl)-3-[3-(methylamino)piperidin-1-yl]propanamide 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-(4-acetylphenyl)-3-piperidin-1-ylpropanamide;hydrochloride
CID 155569851
N-(4-acetylphenyl)-3-[4-(cyclopropanecarbonyl)piperazin-1-yl]propanamide
CID 31932540
N-(4-acetylphenyl)-3-(2,6-dimethylmorpholin-4-yl)propanamide
CID 24588538
3-[(3R)-3-(methanesulfonamido)piperidin-1-yl]-N-phenylpropanamide
CID 95159240
N-(4-acetylphenyl)-2-(3-methylpiperidin-1-yl)acetamide
CID 6914795
3-[3-(methylamino)piperidin-1-yl]-N-(3-sulfamoylphenyl)propanamide;hydrochloride
CID 119919395
N-(4-acetylphenyl)-3-(4-benzoylpiperidin-1-yl)propanamide
CID 33215029
N-(2,5-dichlorophenyl)-3-[3-(methylamino)piperidin-1-yl]propanamide;hydrochloride
CID 119920297
N-(3-fluoro-2-methylphenyl)-3-[3-(methylamino)piperidin-1-yl]propanamide
CID 119920472
4-[3-(methylamino)piperidin-1-yl]-N-(3-methylphenyl)butanamide
CID 62546343
2-[3-(methylamino)piperidin-1-yl]-N-pyridin-4-ylacetamide
CID 119918337
3-[(3S)-3-methylpiperidin-1-yl]-N-phenylpropanamide
CID 739976

Frequently Asked Questions

What is the IUPAC name of N-(4-acetylphenyl)-3-[3-(methylamino)piperidin-1-yl]propanamide?
The IUPAC name of N-(4-acetylphenyl)-3-[3-(methylamino)piperidin-1-yl]propanamide (CID 119919130) is N-(4-acetylphenyl)-3-[3-(methylamino)piperidin-1-yl]propanamide.
What is the SMILES notation for N-(4-acetylphenyl)-3-[3-(methylamino)piperidin-1-yl]propanamide?
The canonical SMILES for N-(4-acetylphenyl)-3-[3-(methylamino)piperidin-1-yl]propanamide is CNC1CCCN(CCC(=O)Nc2ccc(C(C)=O)cc2)C1.
What is the InChIKey of N-(4-acetylphenyl)-3-[3-(methylamino)piperidin-1-yl]propanamide?
The InChIKey is YVZJCHBSGJXUGZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H25N3O2/c1-13(21)14-5-7-15(8-6-14)19-17(22)9-11-20-10-3-4-16(12-20)18-2/h5-8,16,18H,3-4,9-12H2,1-2H3,(H,19,22).
What are the key properties of N-(4-acetylphenyl)-3-[3-(methylamino)piperidin-1-yl]propanamide?
N-(4-acetylphenyl)-3-[3-(methylamino)piperidin-1-yl]propanamide has a molecular weight of 303.41 g/mol, XLogP of 1.90, 6 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-(4-acetylphenyl)-3-[3-(methylamino)piperidin-1-yl]propanamide is sourced from PubChem (CID 119919130), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).